3-hydroxy-N-(1-methylpiperidin-3-yl)pyridine-4-carboxamide

C12H17N3O2 — CID 80706689

IUPAC3-hydroxy-N-(1-methylpiperidin-3-yl)pyridine-4-carboxamide
SMILESCN1CCCC(NC(=O)c2ccncc2O)C1
InChIInChI=1S/C12H17N3O2/c1-15-6-2-3-9(8-15)14-12(17)10-4-5-13-7-11(10)16/h4-5,7,9,16H,2-3,6,8H2,1H3,(H,14,17)
InChIKeyKHRBEMSAVSUSRH-UHFFFAOYSA-N
MW235.29 g/mol
LogP0.61
Rot. Bonds2

About 3-hydroxy-N-(1-methylpiperidin-3-yl)pyridine-4-carboxamide

3-hydroxy-N-(1-methylpiperidin-3-yl)pyridine-4-carboxamide (PubChem CID 80706689) has the molecular formula C12H17N3O2 and a molecular weight of 235.29 g/mol. Its IUPAC name is 3-hydroxy-N-(1-methylpiperidin-3-yl)pyridine-4-carboxamide.

Molecular Properties

Compound Name3-hydroxy-N-(1-methylpiperidin-3-yl)pyridine-4-carboxamide
PubChem CID80706689
Molecular FormulaC12H17N3O2
Molecular Weight235.29 g/mol
Exact Mass235.13
IUPAC Name3-hydroxy-N-(1-methylpiperidin-3-yl)pyridine-4-carboxamide
SMILESCN1CCCC(NC(=O)c2ccncc2O)C1
InChIInChI=1S/C12H17N3O2/c1-15-6-2-3-9(8-15)14-12(17)10-4-5-13-7-11(10)16/h4-5,7,9,16H,2-3,6,8H2,1H3,(H,14,17)
InChIKeyKHRBEMSAVSUSRH-UHFFFAOYSA-N
XLogP0.61
TPSA65.46 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.29
LogP ≤ 50.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-N-(1-methylpiperidin-3-yl)pyridine-3-carboxamide
CID 81243197
3-hydrazinyl-N-(1-methylpiperidin-3-yl)pyridine-4-carboxamide
CID 105071671
2-hydroxy-N-(1-methylpiperidin-3-yl)benzamide
CID 47344376
3-(3-hydroxyprop-1-ynyl)-N-(1-methylpiperidin-3-yl)pyridine-4-carboxamide
CID 66484211
N-(1-methylpiperidin-3-yl)pyrazine-2-carboxamide
CID 110471343
2-(methylamino)-N-(1-methylpiperidin-3-yl)benzamide
CID 61376709
3-hydroxy-N-(thian-3-yl)pyridine-4-carboxamide
CID 115696792
N-(3-aminocyclobutyl)-3-hydroxypyridine-4-carboxamide
CID 81442624
4-cyano-N-(1-methylpyrrolidin-3-yl)pyridine-3-carboxamide
CID 115115642
N-[2-(cycloheptylamino)ethyl]-3-hydroxypyridine-4-carboxamide
CID 115306432
4-(ethylamino)-N-(1-methylpyrrolidin-3-yl)pyridine-3-carboxamide
CID 81239986
2-fluoro-6-hydroxy-N-(1-methylpiperidin-3-yl)benzamide
CID 104917016

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-N-(1-methylpiperidin-3-yl)pyridine-4-carboxamide?
The IUPAC name of 3-hydroxy-N-(1-methylpiperidin-3-yl)pyridine-4-carboxamide (CID 80706689) is 3-hydroxy-N-(1-methylpiperidin-3-yl)pyridine-4-carboxamide.
What is the SMILES notation for 3-hydroxy-N-(1-methylpiperidin-3-yl)pyridine-4-carboxamide?
The canonical SMILES for 3-hydroxy-N-(1-methylpiperidin-3-yl)pyridine-4-carboxamide is CN1CCCC(NC(=O)c2ccncc2O)C1.
What is the InChIKey of 3-hydroxy-N-(1-methylpiperidin-3-yl)pyridine-4-carboxamide?
The InChIKey is KHRBEMSAVSUSRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O2/c1-15-6-2-3-9(8-15)14-12(17)10-4-5-13-7-11(10)16/h4-5,7,9,16H,2-3,6,8H2,1H3,(H,14,17).
What are the key properties of 3-hydroxy-N-(1-methylpiperidin-3-yl)pyridine-4-carboxamide?
3-hydroxy-N-(1-methylpiperidin-3-yl)pyridine-4-carboxamide has a molecular weight of 235.29 g/mol, XLogP of 0.61, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-N-(1-methylpiperidin-3-yl)pyridine-4-carboxamide is sourced from PubChem (CID 80706689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).