1,4-dimethyl-6-oxopyridine-3-carboxamide

C8H10N2O2 — CID 12791806

IUPAC1,4-dimethyl-6-oxopyridine-3-carboxamide
SMILESCc1cc(=O)n(C)cc1C(N)=O
InChIInChI=1S/C8H10N2O2/c1-5-3-7(11)10(2)4-6(5)8(9)12/h3-4H,1-2H3,(H2,9,12)
InChIKeyFGIGIODWTLAJRA-UHFFFAOYSA-N
MW166.18 g/mol
LogP-0.21
Rot. Bonds1

About 1,4-dimethyl-6-oxopyridine-3-carboxamide

1,4-dimethyl-6-oxopyridine-3-carboxamide (PubChem CID 12791806) has the molecular formula C8H10N2O2 and a molecular weight of 166.18 g/mol. Its IUPAC name is 1,4-dimethyl-6-oxopyridine-3-carboxamide.

Molecular Properties

Compound Name1,4-dimethyl-6-oxopyridine-3-carboxamide
PubChem CID12791806
Molecular FormulaC8H10N2O2
Molecular Weight166.18 g/mol
Exact Mass166.07
IUPAC Name1,4-dimethyl-6-oxopyridine-3-carboxamide
SMILESCc1cc(=O)n(C)cc1C(N)=O
InChIInChI=1S/C8H10N2O2/c1-5-3-7(11)10(2)4-6(5)8(9)12/h3-4H,1-2H3,(H2,9,12)
InChIKeyFGIGIODWTLAJRA-UHFFFAOYSA-N
XLogP-0.21
TPSA65.09 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.18
LogP ≤ 5-0.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N1-Methyl-2-pyridone-5-carboxamide
CID 69698
1,6-Dihydro-N-methyl-6-oxonicotinamide
CID 70510
3-Pyridinecarboxamide, 1-ethyl-1,2-dihydro-6-hydroxy-4-methyl-2-oxo-
CID 120131
1-Methyl-2-oxo-1,2-dihydropyridine-4-carboxamide
CID 820601
N,1-dimethyl-6-oxo-1,6-dihydropyridine-3-carboxamide
CID 12374555
N,N-dimethyl-6-oxo-1,6-dihydropyridine-3-carboxamide
CID 19692588
5-(Aminomethyl)-1-methyl-1,2-dihydropyridin-2-one
CID 23569318
6-Hydroxy-n,n-diethylnicotinamide
CID 9899087
1-(~2~H_3_)Methyl-6-oxo-1,6-dihydropyridine-3-carboxamide
CID 71751269
1-Methyl-6-oxo-4-(trifluoromethyl)pyridine-3-carboxamide
CID 137376349
4-(Difluoromethyl)-1-methyl-6-oxopyridine-3-carboxamide
CID 137377141
3-Ethyl-5-fluoro-1-methylpyridin-2-one
CID 153577692

Frequently Asked Questions

What is the IUPAC name of 1,4-dimethyl-6-oxopyridine-3-carboxamide?
The IUPAC name of 1,4-dimethyl-6-oxopyridine-3-carboxamide (CID 12791806) is 1,4-dimethyl-6-oxopyridine-3-carboxamide.
What is the SMILES notation for 1,4-dimethyl-6-oxopyridine-3-carboxamide?
The canonical SMILES for 1,4-dimethyl-6-oxopyridine-3-carboxamide is Cc1cc(=O)n(C)cc1C(N)=O.
What is the InChIKey of 1,4-dimethyl-6-oxopyridine-3-carboxamide?
The InChIKey is FGIGIODWTLAJRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O2/c1-5-3-7(11)10(2)4-6(5)8(9)12/h3-4H,1-2H3,(H2,9,12).
What are the key properties of 1,4-dimethyl-6-oxopyridine-3-carboxamide?
1,4-dimethyl-6-oxopyridine-3-carboxamide has a molecular weight of 166.18 g/mol, XLogP of -0.21, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-dimethyl-6-oxopyridine-3-carboxamide is sourced from PubChem (CID 12791806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).