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1027-91-4

1027-91-4 | 4-Piperidinecarboxamide, 4-(ethylamino)-1-(phenylmethyl)-

CAS No: 1027-91-4 Catalog No: AG00086H MDL No:MFCD00023758

Product Description

Catalog Number:
AG00086H
Chemical Name:
4-Piperidinecarboxamide, 4-(ethylamino)-1-(phenylmethyl)-
CAS Number:
1027-91-4
Molecular Formula:
C15H23N3O
Molecular Weight:
261.3626
MDL Number:
MFCD00023758
IUPAC Name:
1-benzyl-4-(ethylamino)piperidine-4-carboxamide
InChI:
InChI=1S/C15H23N3O/c1-2-17-15(14(16)19)8-10-18(11-9-15)12-13-6-4-3-5-7-13/h3-7,17H,2,8-12H2,1H3,(H2,16,19)
InChI Key:
LPPPBYXGXSHYQJ-UHFFFAOYSA-N
SMILES:
CCNC1(CCN(CC1)Cc1ccccc1)C(=O)N
EC Number:
213-839-4
NSC Number:
72999

Properties

Complexity:
292  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.184g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
261.369g/mol
Monoisotopic Mass:
261.184g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
58.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  

Literature

Title Journal
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

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