3-hydroxy-N-(3-methylsulfanylcyclopentyl)pyridine-4-carboxamide

C12H16N2O2S — CID 103762366

IUPAC3-hydroxy-N-(3-methylsulfanylcyclopentyl)pyridine-4-carboxamide
SMILESCSC1CCC(NC(=O)c2ccncc2O)C1
InChIInChI=1S/C12H16N2O2S/c1-17-9-3-2-8(6-9)14-12(16)10-4-5-13-7-11(10)15/h4-5,7-9,15H,2-3,6H2,1H3,(H,14,16)
InChIKeyYUXJYNVPVMCAIJ-UHFFFAOYSA-N
MW252.34 g/mol
LogP1.80
Rot. Bonds3

About 3-hydroxy-N-(3-methylsulfanylcyclopentyl)pyridine-4-carboxamide

3-hydroxy-N-(3-methylsulfanylcyclopentyl)pyridine-4-carboxamide (PubChem CID 103762366) has the molecular formula C12H16N2O2S and a molecular weight of 252.34 g/mol. Its IUPAC name is 3-hydroxy-N-(3-methylsulfanylcyclopentyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name3-hydroxy-N-(3-methylsulfanylcyclopentyl)pyridine-4-carboxamide
PubChem CID103762366
Molecular FormulaC12H16N2O2S
Molecular Weight252.34 g/mol
Exact Mass252.09
IUPAC Name3-hydroxy-N-(3-methylsulfanylcyclopentyl)pyridine-4-carboxamide
SMILESCSC1CCC(NC(=O)c2ccncc2O)C1
InChIInChI=1S/C12H16N2O2S/c1-17-9-3-2-8(6-9)14-12(16)10-4-5-13-7-11(10)15/h4-5,7-9,15H,2-3,6H2,1H3,(H,14,16)
InChIKeyYUXJYNVPVMCAIJ-UHFFFAOYSA-N
XLogP1.80
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.34
LogP ≤ 51.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-aminocyclobutyl)-3-hydroxypyridine-4-carboxamide
CID 81442624
3-hydroxy-N-(1-methylpiperidin-3-yl)pyridine-4-carboxamide
CID 80706689
4-amino-N-(3-ethylsulfanylcyclopentyl)pyridine-3-carboxamide
CID 105056170
3,6-dichloro-N-(3-methylsulfanylcyclopentyl)pyridazine-4-carboxamide
CID 114122854
3-hydroxy-N-(thian-3-yl)pyridine-4-carboxamide
CID 115696792
2-amino-5-methyl-N-(3-methylsulfanylcyclopentyl)benzamide
CID 114122249
5-bromo-N-(3-methylsulfanylcyclopentyl)pyridine-3-carboxamide
CID 103708503
3-hydroxy-N-(2,2,3,3-tetramethylcyclopropyl)pyridine-4-carboxamide
CID 81443107
4-chloro-N-(3-methylsulfanylcyclopentyl)pyridine-2-carboxamide
CID 103708467
N-cyclopropyl-3-(methylamino)pyridine-4-carboxamide
CID 105068162
2-hydrazinyl-4-methyl-N-(3-methylsulfanylcyclopentyl)benzamide
CID 114124028
N-(3-methylsulfanylcyclopentyl)-1,2,3,4-tetrahydroquinoline-5-carboxamide
CID 104954846

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-N-(3-methylsulfanylcyclopentyl)pyridine-4-carboxamide?
The IUPAC name of 3-hydroxy-N-(3-methylsulfanylcyclopentyl)pyridine-4-carboxamide (CID 103762366) is 3-hydroxy-N-(3-methylsulfanylcyclopentyl)pyridine-4-carboxamide.
What is the SMILES notation for 3-hydroxy-N-(3-methylsulfanylcyclopentyl)pyridine-4-carboxamide?
The canonical SMILES for 3-hydroxy-N-(3-methylsulfanylcyclopentyl)pyridine-4-carboxamide is CSC1CCC(NC(=O)c2ccncc2O)C1.
What is the InChIKey of 3-hydroxy-N-(3-methylsulfanylcyclopentyl)pyridine-4-carboxamide?
The InChIKey is YUXJYNVPVMCAIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O2S/c1-17-9-3-2-8(6-9)14-12(16)10-4-5-13-7-11(10)15/h4-5,7-9,15H,2-3,6H2,1H3,(H,14,16).
What are the key properties of 3-hydroxy-N-(3-methylsulfanylcyclopentyl)pyridine-4-carboxamide?
3-hydroxy-N-(3-methylsulfanylcyclopentyl)pyridine-4-carboxamide has a molecular weight of 252.34 g/mol, XLogP of 1.80, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-N-(3-methylsulfanylcyclopentyl)pyridine-4-carboxamide is sourced from PubChem (CID 103762366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).