3-hydroxy-N,1,6-trimethyl-4-oxopyridine-2-carboxamide

C9H12N2O3 — CID 54690006

IUPAC3-hydroxy-N,1,6-trimethyl-4-oxopyridine-2-carboxamide
SMILESCNC(=O)c1c(O)c(=O)cc(C)n1C
InChIInChI=1S/C9H12N2O3/c1-5-4-6(12)8(13)7(11(5)3)9(14)10-2/h4,13H,1-3H3,(H,10,14)
InChIKeyJFWSELHOSFRVMD-UHFFFAOYSA-N
MW196.21 g/mol
LogP-0.24
Rot. Bonds1

About 3-hydroxy-N,1,6-trimethyl-4-oxopyridine-2-carboxamide

3-hydroxy-N,1,6-trimethyl-4-oxopyridine-2-carboxamide (PubChem CID 54690006) has the molecular formula C9H12N2O3 and a molecular weight of 196.21 g/mol. Its IUPAC name is 3-hydroxy-N,1,6-trimethyl-4-oxopyridine-2-carboxamide.

Molecular Properties

Compound Name3-hydroxy-N,1,6-trimethyl-4-oxopyridine-2-carboxamide
PubChem CID54690006
Molecular FormulaC9H12N2O3
Molecular Weight196.21 g/mol
Exact Mass196.08
IUPAC Name3-hydroxy-N,1,6-trimethyl-4-oxopyridine-2-carboxamide
SMILESCNC(=O)c1c(O)c(=O)cc(C)n1C
InChIInChI=1S/C9H12N2O3/c1-5-4-6(12)8(13)7(11(5)3)9(14)10-2/h4,13H,1-3H3,(H,10,14)
InChIKeyJFWSELHOSFRVMD-UHFFFAOYSA-N
XLogP-0.24
TPSA71.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.21
LogP ≤ 5-0.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-hydroxy-N-[2-(methylamino)-2-oxoethyl]-4-oxo-1H-pyridine-2-carboxamide;hydrochloride
CID 54737736
N-[(3-hydroxy-1,6-dimethyl-4-oxo-1,4-dihydropyridin-2-yl)methyl]propanamide
CID 10263040
N-[(3-hydroxy-1,6-dimethyl-4-oxo-2-pyridinyl)methyl]butanamide
CID 141519884
N-[(3-Hydroxy-1,6-dimethyl-4-oxo-1,4-dihydro-2-pyridinyl)methyl]acetamide
CID 10081839
N-[(3-hydroxy-1,6-dimethyl-4-oxo-1,4-dihydropyridin-2-yl)methyl]-2-methylpropanamide
CID 10331765
N-[2-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)ethyl]prop-2-enamide
CID 44328241
N-[2-(3-hydroxy-2-methyl-4-oxo-1-pyridinyl)ethyl]acetamide
CID 44341576
3-hydroxy-N,6-dimethyl-4-oxo-1H-pyridine-2-carboxamide
CID 101517382
3-Hydroxy-1,6-dimethyl-2-[(propan-2-ylamino)methyl]pyridin-4-one
CID 162657280
2-(Butylaminomethyl)-3-hydroxy-1,6-dimethylpyridin-4-one
CID 162659052
3-hydroxy-N-[2-(methylamino)-2-oxoethyl]-4-oxo-1H-pyridine-2-carboxamide
CID 54684254
2-Pyridinecarboxamide, 1-cyclopropyl-1,4-dihydro-3-hydroxy-N,6-dimethyl-4-oxo-
CID 54718367

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-N,1,6-trimethyl-4-oxopyridine-2-carboxamide?
The IUPAC name of 3-hydroxy-N,1,6-trimethyl-4-oxopyridine-2-carboxamide (CID 54690006) is 3-hydroxy-N,1,6-trimethyl-4-oxopyridine-2-carboxamide.
What is the SMILES notation for 3-hydroxy-N,1,6-trimethyl-4-oxopyridine-2-carboxamide?
The canonical SMILES for 3-hydroxy-N,1,6-trimethyl-4-oxopyridine-2-carboxamide is CNC(=O)c1c(O)c(=O)cc(C)n1C.
What is the InChIKey of 3-hydroxy-N,1,6-trimethyl-4-oxopyridine-2-carboxamide?
The InChIKey is JFWSELHOSFRVMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O3/c1-5-4-6(12)8(13)7(11(5)3)9(14)10-2/h4,13H,1-3H3,(H,10,14).
What are the key properties of 3-hydroxy-N,1,6-trimethyl-4-oxopyridine-2-carboxamide?
3-hydroxy-N,1,6-trimethyl-4-oxopyridine-2-carboxamide has a molecular weight of 196.21 g/mol, XLogP of -0.24, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-N,1,6-trimethyl-4-oxopyridine-2-carboxamide is sourced from PubChem (CID 54690006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).