3-hydroxy-N-(2-hydroxypentyl)pyridine-4-carboxamide

C11H16N2O3 — CID 115744615

IUPAC3-hydroxy-N-(2-hydroxypentyl)pyridine-4-carboxamide
SMILESCCCC(O)CNC(=O)c1ccncc1O
InChIInChI=1S/C11H16N2O3/c1-2-3-8(14)6-13-11(16)9-4-5-12-7-10(9)15/h4-5,7-8,14-15H,2-3,6H2,1H3,(H,13,16)
InChIKeyWCXYQTRVILOVOR-UHFFFAOYSA-N
MW224.26 g/mol
LogP0.68
Rot. Bonds5

About 3-hydroxy-N-(2-hydroxypentyl)pyridine-4-carboxamide

3-hydroxy-N-(2-hydroxypentyl)pyridine-4-carboxamide (PubChem CID 115744615) has the molecular formula C11H16N2O3 and a molecular weight of 224.26 g/mol. Its IUPAC name is 3-hydroxy-N-(2-hydroxypentyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name3-hydroxy-N-(2-hydroxypentyl)pyridine-4-carboxamide
PubChem CID115744615
Molecular FormulaC11H16N2O3
Molecular Weight224.26 g/mol
Exact Mass224.12
IUPAC Name3-hydroxy-N-(2-hydroxypentyl)pyridine-4-carboxamide
SMILESCCCC(O)CNC(=O)c1ccncc1O
InChIInChI=1S/C11H16N2O3/c1-2-3-8(14)6-13-11(16)9-4-5-12-7-10(9)15/h4-5,7-8,14-15H,2-3,6H2,1H3,(H,13,16)
InChIKeyWCXYQTRVILOVOR-UHFFFAOYSA-N
XLogP0.68
TPSA82.45 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 50.68
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

3-hydroxy-N-(3-hydroxybutyl)pyridine-4-carboxamide
CID 81443117
N-(2-amino-3-ethylpentyl)-3-hydroxypyridine-4-carboxamide
CID 106286387
N-(4-bromo-2-methylbutyl)-3-hydroxypyridine-4-carboxamide
CID 114316791
N-hexan-3-yl-3-hydroxypyridine-4-carboxamide
CID 81442686
N-(2-chloro-3-methoxypropyl)-3-hydroxypyridine-4-carboxamide
CID 114298783
N-[2-[cyclopropyl(methyl)amino]propyl]-3-hydroxypyridine-4-carboxamide
CID 103762346
3-hydroxy-N-[1-oxo-1-(propylamino)propan-2-yl]pyridine-4-carboxamide
CID 80707403
2-hydroxy-N-(2-hydroxypentyl)-3-methylbenzamide
CID 113268457
N-(2-bromoethyl)-3-hydroxypyridine-4-carboxamide
CID 114307487
1-(2-hydroxypentyl)-3-pyridin-4-ylurea
CID 111119369
tris(3-hydroxy-N-methylpyridine-4-carboxamide);iron
CID 163419095
(2R)-2-[(3-hydroxypyridine-4-carbonyl)amino]butanoic acid
CID 81445874

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-N-(2-hydroxypentyl)pyridine-4-carboxamide?
The IUPAC name of 3-hydroxy-N-(2-hydroxypentyl)pyridine-4-carboxamide (CID 115744615) is 3-hydroxy-N-(2-hydroxypentyl)pyridine-4-carboxamide.
What is the SMILES notation for 3-hydroxy-N-(2-hydroxypentyl)pyridine-4-carboxamide?
The canonical SMILES for 3-hydroxy-N-(2-hydroxypentyl)pyridine-4-carboxamide is CCCC(O)CNC(=O)c1ccncc1O.
What is the InChIKey of 3-hydroxy-N-(2-hydroxypentyl)pyridine-4-carboxamide?
The InChIKey is WCXYQTRVILOVOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O3/c1-2-3-8(14)6-13-11(16)9-4-5-12-7-10(9)15/h4-5,7-8,14-15H,2-3,6H2,1H3,(H,13,16).
What are the key properties of 3-hydroxy-N-(2-hydroxypentyl)pyridine-4-carboxamide?
3-hydroxy-N-(2-hydroxypentyl)pyridine-4-carboxamide has a molecular weight of 224.26 g/mol, XLogP of 0.68, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-N-(2-hydroxypentyl)pyridine-4-carboxamide is sourced from PubChem (CID 115744615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).