Home Aminos 2-{[(2-aminoethyl)amino](hydroxy)methylidene}-2,3-dihydropyridin-3-one

2-{[(2-aminoethyl)amino](hydroxy)methylidene}-2,3-dihydropyridin-3-one

CAS No.:
1281694-75-4
Catalog Number:
AG01AHCV
Molecular Formula:
C8H11N3O2
Molecular Weight:
181.1918
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Product Description
Catalog Number:
AG01AHCV
Chemical Name:
2-{[(2-aminoethyl)amino](hydroxy)methylidene}-2,3-dihydropyridin-3-one
CAS Number:
1281694-75-4
Molecular Formula:
C8H11N3O2
Molecular Weight:
181.1918
MDL Number:
MFCD28155405
IUPAC Name:
N-(2-aminoethyl)-3-hydroxypyridine-2-carboxamide
InChI:
InChI=1S/C8H11N3O2/c9-3-5-11-8(13)7-6(12)2-1-4-10-7/h1-2,4,12H,3,5,9H2,(H,11,13)
InChI Key:
ZXTXADWNRQCBJW-UHFFFAOYSA-N
SMILES:
NCCNC(=C1N=CC=CC1=O)O
Properties
Complexity:
175  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.085g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
181.195g/mol
Monoisotopic Mass:
181.085g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
88.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1  
Properties