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827588-04-5

827588-04-5 | 3-Pyridinecarboxamide, 6-amino-N-[1-(hydroxymethyl)propyl]-

CAS No: 827588-04-5 Catalog No: AG004Z0U MDL No:

Product Description

Catalog Number:
AG004Z0U
Chemical Name:
3-Pyridinecarboxamide, 6-amino-N-[1-(hydroxymethyl)propyl]-
CAS Number:
827588-04-5
Molecular Formula:
C10H15N3O2
Molecular Weight:
209.2450
IUPAC Name:
6-amino-N-(1-hydroxybutan-2-yl)pyridine-3-carboxamide
InChI:
InChI=1S/C10H15N3O2/c1-2-8(6-14)13-10(15)7-3-4-9(11)12-5-7/h3-5,8,14H,2,6H2,1H3,(H2,11,12)(H,13,15)
InChI Key:
CLWDGDCABGLMEX-UHFFFAOYSA-N
SMILES:
CCC(NC(=O)c1ccc(nc1)N)CO

Properties

Complexity:
211  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.116g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
209.249g/mol
Monoisotopic Mass:
209.116g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
88.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1  

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