N-[(1-hydroxycyclopentyl)methyl]-6-phenoxypyridine-3-carboxamide

C18H20N2O3 — CID 111333099

IUPACN-[(1-hydroxycyclopentyl)methyl]-6-phenoxypyridine-3-carboxamide
SMILESO=C(NCC1(O)CCCC1)c1ccc(Oc2ccccc2)nc1
InChIInChI=1S/C18H20N2O3/c21-17(20-13-18(22)10-4-5-11-18)14-8-9-16(19-12-14)23-15-6-2-1-3-7-15/h1-3,6-9,12,22H,4-5,10-11,13H2,(H,20,21)
InChIKeyPMCFVIZSQOQQNX-UHFFFAOYSA-N
MW312.37 g/mol
LogP2.91
Rot. Bonds5

About N-[(1-hydroxycyclopentyl)methyl]-6-phenoxypyridine-3-carboxamide

N-[(1-hydroxycyclopentyl)methyl]-6-phenoxypyridine-3-carboxamide (PubChem CID 111333099) has the molecular formula C18H20N2O3 and a molecular weight of 312.37 g/mol. Its IUPAC name is N-[(1-hydroxycyclopentyl)methyl]-6-phenoxypyridine-3-carboxamide.

Molecular Properties

Compound NameN-[(1-hydroxycyclopentyl)methyl]-6-phenoxypyridine-3-carboxamide
PubChem CID111333099
Molecular FormulaC18H20N2O3
Molecular Weight312.37 g/mol
Exact Mass312.15
IUPAC NameN-[(1-hydroxycyclopentyl)methyl]-6-phenoxypyridine-3-carboxamide
SMILESO=C(NCC1(O)CCCC1)c1ccc(Oc2ccccc2)nc1
InChIInChI=1S/C18H20N2O3/c21-17(20-13-18(22)10-4-5-11-18)14-8-9-16(19-12-14)23-15-6-2-1-3-7-15/h1-3,6-9,12,22H,4-5,10-11,13H2,(H,20,21)
InChIKeyPMCFVIZSQOQQNX-UHFFFAOYSA-N
XLogP2.91
TPSA71.45 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 52.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(1-hydroxycyclobutyl)methyl]-6-phenoxypyridine-3-carboxamide
CID 111539349
N-[(1-hydroxycyclobutyl)methyl]-4-phenoxybenzamide
CID 111445607
2-[(6-phenoxypyridine-3-carbonyl)amino]acetic acid
CID 163226654
N-(2-methoxyethyl)-6-phenoxypyridine-3-carboxamide
CID 87000425
6-chloro-N-[(1-hydroxycyclohexyl)methyl]pyridine-3-carboxamide
CID 65107127
N-[2-[(4-chlorobenzoyl)amino]ethyl]-6-phenoxypyridine-3-carboxamide
CID 78888100
N-(2-hydroxypropyl)-6-phenoxypyridine-3-carboxamide
CID 78888027
N-[(1-hydroxy-4-methylcyclohexyl)methyl]-6-methoxypyridine-3-carboxamide
CID 65120212
2-ethyl-2-[[(6-phenoxypyridine-3-carbonyl)amino]methyl]butanoic acid
CID 120533319
6-phenoxy-N-(2-pyridin-2-ylethyl)pyridine-3-carboxamide
CID 87000850
6-(dimethylamino)-N-[(1-hydroxycyclobutyl)methyl]pyridine-3-carboxamide
CID 111445550
N-[3-(2-methoxyethoxy)propyl]-6-phenoxypyridine-3-carboxamide
CID 87002549

Frequently Asked Questions

What is the IUPAC name of N-[(1-hydroxycyclopentyl)methyl]-6-phenoxypyridine-3-carboxamide?
The IUPAC name of N-[(1-hydroxycyclopentyl)methyl]-6-phenoxypyridine-3-carboxamide (CID 111333099) is N-[(1-hydroxycyclopentyl)methyl]-6-phenoxypyridine-3-carboxamide.
What is the SMILES notation for N-[(1-hydroxycyclopentyl)methyl]-6-phenoxypyridine-3-carboxamide?
The canonical SMILES for N-[(1-hydroxycyclopentyl)methyl]-6-phenoxypyridine-3-carboxamide is O=C(NCC1(O)CCCC1)c1ccc(Oc2ccccc2)nc1.
What is the InChIKey of N-[(1-hydroxycyclopentyl)methyl]-6-phenoxypyridine-3-carboxamide?
The InChIKey is PMCFVIZSQOQQNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O3/c21-17(20-13-18(22)10-4-5-11-18)14-8-9-16(19-12-14)23-15-6-2-1-3-7-15/h1-3,6-9,12,22H,4-5,10-11,13H2,(H,20,21).
What are the key properties of N-[(1-hydroxycyclopentyl)methyl]-6-phenoxypyridine-3-carboxamide?
N-[(1-hydroxycyclopentyl)methyl]-6-phenoxypyridine-3-carboxamide has a molecular weight of 312.37 g/mol, XLogP of 2.91, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-hydroxycyclopentyl)methyl]-6-phenoxypyridine-3-carboxamide is sourced from PubChem (CID 111333099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).