N-(2-hydroxypropyl)-6-phenoxypyridine-3-carboxamide

C15H16N2O3 — CID 78888027

IUPACN-(2-hydroxypropyl)-6-phenoxypyridine-3-carboxamide
SMILESCC(O)CNC(=O)c1ccc(Oc2ccccc2)nc1
InChIInChI=1S/C15H16N2O3/c1-11(18)9-17-15(19)12-7-8-14(16-10-12)20-13-5-3-2-4-6-13/h2-8,10-11,18H,9H2,1H3,(H,17,19)
InChIKeyHTKSVKJEZKGUNN-UHFFFAOYSA-N
MW272.30 g/mol
LogP1.98
Rot. Bonds5

About N-(2-hydroxypropyl)-6-phenoxypyridine-3-carboxamide

N-(2-hydroxypropyl)-6-phenoxypyridine-3-carboxamide (PubChem CID 78888027) has the molecular formula C15H16N2O3 and a molecular weight of 272.30 g/mol. Its IUPAC name is N-(2-hydroxypropyl)-6-phenoxypyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxypropyl)-6-phenoxypyridine-3-carboxamide
PubChem CID78888027
Molecular FormulaC15H16N2O3
Molecular Weight272.30 g/mol
Exact Mass272.12
IUPAC NameN-(2-hydroxypropyl)-6-phenoxypyridine-3-carboxamide
SMILESCC(O)CNC(=O)c1ccc(Oc2ccccc2)nc1
InChIInChI=1S/C15H16N2O3/c1-11(18)9-17-15(19)12-7-8-14(16-10-12)20-13-5-3-2-4-6-13/h2-8,10-11,18H,9H2,1H3,(H,17,19)
InChIKeyHTKSVKJEZKGUNN-UHFFFAOYSA-N
XLogP1.98
TPSA71.45 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.30
LogP ≤ 51.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(6-phenoxypyridine-3-carbonyl)amino]acetic acid
CID 163226654
N-(2-methyl-3-pyrazol-1-ylpropyl)-6-phenoxypyridine-3-carboxamide
CID 87018896
N-(2-methoxyethyl)-6-phenoxypyridine-3-carboxamide
CID 87000425
N-[2-[(4-chlorobenzoyl)amino]ethyl]-6-phenoxypyridine-3-carboxamide
CID 78888100
2-ethyl-2-[[(6-phenoxypyridine-3-carbonyl)amino]methyl]butanoic acid
CID 120533319
N-[[4-(2-methylpropanoylamino)phenyl]methyl]-6-phenoxypyridine-3-carboxamide
CID 78888482
N-[3-(2-methoxyethoxy)propyl]-6-phenoxypyridine-3-carboxamide
CID 87002549
methyl 3-methyl-2-[(6-phenoxypyridine-3-carbonyl)amino]butanoate
CID 78889163
N-[(2R)-2-hydroxypropyl]-6-methylpyridine-3-carboxamide
CID 83031410
6-phenoxy-N-(2-pyridin-2-ylethyl)pyridine-3-carboxamide
CID 87000850
N-[(1-hydroxycyclobutyl)methyl]-6-phenoxypyridine-3-carboxamide
CID 111539349
N-[(1-hydroxycyclopentyl)methyl]-6-phenoxypyridine-3-carboxamide
CID 111333099

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxypropyl)-6-phenoxypyridine-3-carboxamide?
The IUPAC name of N-(2-hydroxypropyl)-6-phenoxypyridine-3-carboxamide (CID 78888027) is N-(2-hydroxypropyl)-6-phenoxypyridine-3-carboxamide.
What is the SMILES notation for N-(2-hydroxypropyl)-6-phenoxypyridine-3-carboxamide?
The canonical SMILES for N-(2-hydroxypropyl)-6-phenoxypyridine-3-carboxamide is CC(O)CNC(=O)c1ccc(Oc2ccccc2)nc1.
What is the InChIKey of N-(2-hydroxypropyl)-6-phenoxypyridine-3-carboxamide?
The InChIKey is HTKSVKJEZKGUNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O3/c1-11(18)9-17-15(19)12-7-8-14(16-10-12)20-13-5-3-2-4-6-13/h2-8,10-11,18H,9H2,1H3,(H,17,19).
What are the key properties of N-(2-hydroxypropyl)-6-phenoxypyridine-3-carboxamide?
N-(2-hydroxypropyl)-6-phenoxypyridine-3-carboxamide has a molecular weight of 272.30 g/mol, XLogP of 1.98, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxypropyl)-6-phenoxypyridine-3-carboxamide is sourced from PubChem (CID 78888027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).