3-hydroxy-N-[1-(hydroxymethyl)cyclopentyl]pyridine-2-carboxamide

C12H16N2O3 — CID 55081325

IUPAC3-hydroxy-N-[1-(hydroxymethyl)cyclopentyl]pyridine-2-carboxamide
SMILESO=C(NC1(CO)CCCC1)c1ncccc1O
InChIInChI=1S/C12H16N2O3/c15-8-12(5-1-2-6-12)14-11(17)10-9(16)4-3-7-13-10/h3-4,7,15-16H,1-2,5-6,8H2,(H,14,17)
InChIKeyPFQSSKYVKYCRNV-UHFFFAOYSA-N
MW236.27 g/mol
LogP0.82
Rot. Bonds3

About 3-hydroxy-N-[1-(hydroxymethyl)cyclopentyl]pyridine-2-carboxamide

3-hydroxy-N-[1-(hydroxymethyl)cyclopentyl]pyridine-2-carboxamide (PubChem CID 55081325) has the molecular formula C12H16N2O3 and a molecular weight of 236.27 g/mol. Its IUPAC name is 3-hydroxy-N-[1-(hydroxymethyl)cyclopentyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name3-hydroxy-N-[1-(hydroxymethyl)cyclopentyl]pyridine-2-carboxamide
PubChem CID55081325
Molecular FormulaC12H16N2O3
Molecular Weight236.27 g/mol
Exact Mass236.12
IUPAC Name3-hydroxy-N-[1-(hydroxymethyl)cyclopentyl]pyridine-2-carboxamide
SMILESO=C(NC1(CO)CCCC1)c1ncccc1O
InChIInChI=1S/C12H16N2O3/c15-8-12(5-1-2-6-12)14-11(17)10-9(16)4-3-7-13-10/h3-4,7,15-16H,1-2,5-6,8H2,(H,14,17)
InChIKeyPFQSSKYVKYCRNV-UHFFFAOYSA-N
XLogP0.82
TPSA82.45 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.27
LogP ≤ 50.82
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-[[1-(hydroxymethyl)cyclohexyl]carbamoyl]pyridine-3-carboxylic acid
CID 63614286
3-amino-N-[1-(hydroxymethyl)cyclohexyl]pyridine-2-carboxamide
CID 113447709
N-[1-(hydroxymethyl)cyclopropyl]-3-methylpyridine-2-carboxamide
CID 115877759
2-[1-[(3-methylpyridine-2-carbonyl)amino]cyclopentyl]acetic acid
CID 64671017
N-[1-(hydroxymethyl)cyclohexyl]pyridine-3-carboxamide
CID 62520732
3-fluoro-N-[4-(hydroxymethyl)-1-methylpiperidin-4-yl]pyridine-2-carboxamide
CID 134434700
3-chloro-N-[4-(hydroxymethyl)-1-methylpiperidin-4-yl]pyridine-2-carboxamide
CID 134434697
3-hydroxy-N-(3-methylpyrrolidin-3-yl)pyridine-2-carboxamide
CID 107423037
3-hydroxypyridine-2-carbohydrazide
CID 45083058
3-hydroxy-N-(4-methylpiperidin-4-yl)pyridine-2-carboxamide
CID 114696622
1-[1-(hydroxymethyl)cyclopentyl]-3-pyridin-2-ylurea
CID 111911114
N-[1-(hydroxymethyl)cyclopentyl]pyrazine-2-carboxamide
CID 62519593

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-N-[1-(hydroxymethyl)cyclopentyl]pyridine-2-carboxamide?
The IUPAC name of 3-hydroxy-N-[1-(hydroxymethyl)cyclopentyl]pyridine-2-carboxamide (CID 55081325) is 3-hydroxy-N-[1-(hydroxymethyl)cyclopentyl]pyridine-2-carboxamide.
What is the SMILES notation for 3-hydroxy-N-[1-(hydroxymethyl)cyclopentyl]pyridine-2-carboxamide?
The canonical SMILES for 3-hydroxy-N-[1-(hydroxymethyl)cyclopentyl]pyridine-2-carboxamide is O=C(NC1(CO)CCCC1)c1ncccc1O.
What is the InChIKey of 3-hydroxy-N-[1-(hydroxymethyl)cyclopentyl]pyridine-2-carboxamide?
The InChIKey is PFQSSKYVKYCRNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O3/c15-8-12(5-1-2-6-12)14-11(17)10-9(16)4-3-7-13-10/h3-4,7,15-16H,1-2,5-6,8H2,(H,14,17).
What are the key properties of 3-hydroxy-N-[1-(hydroxymethyl)cyclopentyl]pyridine-2-carboxamide?
3-hydroxy-N-[1-(hydroxymethyl)cyclopentyl]pyridine-2-carboxamide has a molecular weight of 236.27 g/mol, XLogP of 0.82, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-N-[1-(hydroxymethyl)cyclopentyl]pyridine-2-carboxamide is sourced from PubChem (CID 55081325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).