CAS 24813-21-6 | 3-Pyridinecarboxamide, N-tricyclo[3.3.1.13,7]dec-1-yl- | CAS Number 24813-21-6

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24813-21-6 | 3-Pyridinecarboxamide, N-tricyclo[3.3.1.13,7]dec-1-yl-

CAS No: 24813-21-6 Catalog No: AG002PJH MDL No:

Product Description

Catalog Number:

AG002PJH

Chemical Name:

3-Pyridinecarboxamide, N-tricyclo[3.3.1.13,7]dec-1-yl-

CAS Number:

24813-21-6

Molecular Formula:

C16H20N2O

Molecular Weight:

256.3428

IUPAC Name:

N-(1-adamantyl)pyridine-3-carboxamide

InChI:

InChI=1S/C16H20N2O/c19-15(14-2-1-3-17-10-14)18-16-7-11-4-12(8-16)6-13(5-11)9-16/h1-3,10-13H,4-9H2,(H,18,19)

InChI Key:

OHZXNEWKZYPAFC-UHFFFAOYSA-N

SMILES:

O=C(c1cccnc1)NC12CC3CC(C2)CC(C1)C3

Properties

Complexity:

338

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

256.158g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

256.349g/mol

Monoisotopic Mass:

256.158g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

42A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.7

Literature

Title	Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.	Bioorganic & medicinal chemistry letters 20101101
Microsphere-based protease assays and screening application for lethal factor and factor Xa.	Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501