N-(2,3-dihydroxypropyl)-6-oxo-1H-pyridine-3-carboxamide

C9H12N2O4 — CID 66176023

IUPACN-(2,3-dihydroxypropyl)-6-oxo-1H-pyridine-3-carboxamide
SMILESO=C(NCC(O)CO)c1ccc(=O)[nH]c1
InChIInChI=1S/C9H12N2O4/c12-5-7(13)4-11-9(15)6-1-2-8(14)10-3-6/h1-3,7,12-13H,4-5H2,(H,10,14)(H,11,15)
InChIKeySNMAGMSMTMLHSC-UHFFFAOYSA-N
MW212.20 g/mol
LogP-1.54
Rot. Bonds4

About N-(2,3-dihydroxypropyl)-6-oxo-1H-pyridine-3-carboxamide

N-(2,3-dihydroxypropyl)-6-oxo-1H-pyridine-3-carboxamide (PubChem CID 66176023) has the molecular formula C9H12N2O4 and a molecular weight of 212.20 g/mol. Its IUPAC name is N-(2,3-dihydroxypropyl)-6-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2,3-dihydroxypropyl)-6-oxo-1H-pyridine-3-carboxamide
PubChem CID66176023
Molecular FormulaC9H12N2O4
Molecular Weight212.20 g/mol
Exact Mass212.08
IUPAC NameN-(2,3-dihydroxypropyl)-6-oxo-1H-pyridine-3-carboxamide
SMILESO=C(NCC(O)CO)c1ccc(=O)[nH]c1
InChIInChI=1S/C9H12N2O4/c12-5-7(13)4-11-9(15)6-1-2-8(14)10-3-6/h1-3,7,12-13H,4-5H2,(H,10,14)(H,11,15)
InChIKeySNMAGMSMTMLHSC-UHFFFAOYSA-N
XLogP-1.54
TPSA102.42 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.20
LogP ≤ 5-1.54
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Analyze N-(2,3-dihydroxypropyl)-6-oxo-1H-pyridine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[2-hydroxy-3-(2-oxo-1-pyridinyl)propyl]-6-oxo-1H-pyridine-3-carboxamide
CID 72719918
N-(2-hydroxyethyl)-6-oxo-1H-pyridine-3-carboxamide
CID 43389064
6-oxo-1H-pyridine-3-carbohydrazide
CID 11051863
N-(3-hydroxy-4-methoxybutyl)-6-oxo-1H-pyridine-3-carboxamide
CID 103877366
N-(2,3-dihydroxypropyl)-2-hydroxy-6-oxo-1H-pyridine-4-carboxamide
CID 66177293
N-[2-(2-bromoethyl)pentyl]-6-oxo-1H-pyridine-3-carboxamide
CID 114145848
N-(2,3-dihydroxypropyl)pyridine-4-carboxamide
CID 66176252
N-(2,3-dihydroxypropyl)-3,4-difluorobenzamide
CID 66176013
N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]-6-oxo-1H-pyridine-3-carboxamide
CID 107861304
N-(2,3-dihydroxypropyl)-1H-pyrrole-2-carboxamide
CID 66177691
N-(2-methyl-3-piperidin-1-ylpropyl)-6-oxo-1H-pyridine-3-carboxamide
CID 47292410
N-[2-(2-chlorophenyl)-2-(dimethylamino)ethyl]-6-oxo-1H-pyridine-3-carboxamide
CID 110622059

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydroxypropyl)-6-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-(2,3-dihydroxypropyl)-6-oxo-1H-pyridine-3-carboxamide (CID 66176023) is N-(2,3-dihydroxypropyl)-6-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-(2,3-dihydroxypropyl)-6-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-(2,3-dihydroxypropyl)-6-oxo-1H-pyridine-3-carboxamide is O=C(NCC(O)CO)c1ccc(=O)[nH]c1.
What is the InChIKey of N-(2,3-dihydroxypropyl)-6-oxo-1H-pyridine-3-carboxamide?
The InChIKey is SNMAGMSMTMLHSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O4/c12-5-7(13)4-11-9(15)6-1-2-8(14)10-3-6/h1-3,7,12-13H,4-5H2,(H,10,14)(H,11,15).
What are the key properties of N-(2,3-dihydroxypropyl)-6-oxo-1H-pyridine-3-carboxamide?
N-(2,3-dihydroxypropyl)-6-oxo-1H-pyridine-3-carboxamide has a molecular weight of 212.20 g/mol, XLogP of -1.54, 4 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydroxypropyl)-6-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 66176023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).