3-hydroxy-N-[[1-(2-methylpropyl)cyclopentyl]methyl]pyridine-4-carboxamide

C16H24N2O2 — CID 81443017

IUPAC3-hydroxy-N-[[1-(2-methylpropyl)cyclopentyl]methyl]pyridine-4-carboxamide
SMILESCC(C)CC1(CNC(=O)c2ccncc2O)CCCC1
InChIInChI=1S/C16H24N2O2/c1-12(2)9-16(6-3-4-7-16)11-18-15(20)13-5-8-17-10-14(13)19/h5,8,10,12,19H,3-4,6-7,9,11H2,1-2H3,(H,18,20)
InChIKeyOYSZTDCECRPPGE-UHFFFAOYSA-N
MW276.38 g/mol
LogP3.12
Rot. Bonds5

About 3-hydroxy-N-[[1-(2-methylpropyl)cyclopentyl]methyl]pyridine-4-carboxamide

3-hydroxy-N-[[1-(2-methylpropyl)cyclopentyl]methyl]pyridine-4-carboxamide (PubChem CID 81443017) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 3-hydroxy-N-[[1-(2-methylpropyl)cyclopentyl]methyl]pyridine-4-carboxamide.

Molecular Properties

Compound Name3-hydroxy-N-[[1-(2-methylpropyl)cyclopentyl]methyl]pyridine-4-carboxamide
PubChem CID81443017
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC Name3-hydroxy-N-[[1-(2-methylpropyl)cyclopentyl]methyl]pyridine-4-carboxamide
SMILESCC(C)CC1(CNC(=O)c2ccncc2O)CCCC1
InChIInChI=1S/C16H24N2O2/c1-12(2)9-16(6-3-4-7-16)11-18-15(20)13-5-8-17-10-14(13)19/h5,8,10,12,19H,3-4,6-7,9,11H2,1-2H3,(H,18,20)
InChIKeyOYSZTDCECRPPGE-UHFFFAOYSA-N
XLogP3.12
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 53.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(methylamino)-N-[[1-(2-methylpropyl)cyclopentyl]methyl]pyridine-4-carboxamide
CID 105070730
N-[[1-(aminomethyl)cyclohexyl]methyl]-3-hydroxypyridine-4-carboxamide
CID 103970138
N-[[1-(2-chloroethyl)cyclopropyl]methyl]-3-hydroxypyridine-4-carboxamide
CID 114758192
2-amino-5-hydroxy-N-[[1-(2-methylpropyl)cyclopentyl]methyl]benzamide
CID 107075669
3-hydroxy-N-(3-hydroxybutyl)pyridine-4-carboxamide
CID 81443117
3-fluoro-N-[[1-(hydroxymethyl)cyclopentyl]methyl]pyridine-4-carboxamide
CID 115362736
N-[[1-(hydroxymethyl)cyclopentyl]methyl]-3-methoxypyridine-4-carboxamide
CID 105063923
3-chloro-N-[[1-(chloromethyl)cyclohexyl]methyl]pyridine-4-carboxamide
CID 113359928
3-hydroxy-N-[1-oxo-1-(propylamino)propan-2-yl]pyridine-4-carboxamide
CID 80707403
N-[[1-(chloromethyl)cyclohexyl]methyl]-3-fluoropyridine-4-carboxamide
CID 113359929
N-[(1-ethylcyclobutyl)methyl]-4-(methylamino)pyridine-3-carboxamide
CID 114109624
N-[[1-(bromomethyl)cyclohexyl]methyl]-3-chloropyridine-4-carboxamide
CID 103969750

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-N-[[1-(2-methylpropyl)cyclopentyl]methyl]pyridine-4-carboxamide?
The IUPAC name of 3-hydroxy-N-[[1-(2-methylpropyl)cyclopentyl]methyl]pyridine-4-carboxamide (CID 81443017) is 3-hydroxy-N-[[1-(2-methylpropyl)cyclopentyl]methyl]pyridine-4-carboxamide.
What is the SMILES notation for 3-hydroxy-N-[[1-(2-methylpropyl)cyclopentyl]methyl]pyridine-4-carboxamide?
The canonical SMILES for 3-hydroxy-N-[[1-(2-methylpropyl)cyclopentyl]methyl]pyridine-4-carboxamide is CC(C)CC1(CNC(=O)c2ccncc2O)CCCC1.
What is the InChIKey of 3-hydroxy-N-[[1-(2-methylpropyl)cyclopentyl]methyl]pyridine-4-carboxamide?
The InChIKey is OYSZTDCECRPPGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-12(2)9-16(6-3-4-7-16)11-18-15(20)13-5-8-17-10-14(13)19/h5,8,10,12,19H,3-4,6-7,9,11H2,1-2H3,(H,18,20).
What are the key properties of 3-hydroxy-N-[[1-(2-methylpropyl)cyclopentyl]methyl]pyridine-4-carboxamide?
3-hydroxy-N-[[1-(2-methylpropyl)cyclopentyl]methyl]pyridine-4-carboxamide has a molecular weight of 276.38 g/mol, XLogP of 3.12, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-N-[[1-(2-methylpropyl)cyclopentyl]methyl]pyridine-4-carboxamide is sourced from PubChem (CID 81443017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).