ethane;N-methyl-6-oxo-1-phenylpyridine-3-carboxamide

C15H18N2O2 — CID 142575628

IUPACethane;N-methyl-6-oxo-1-phenylpyridine-3-carboxamide
SMILESCC.CNC(=O)c1ccc(=O)n(-c2ccccc2)c1
InChIInChI=1S/C13H12N2O2.C2H6/c1-14-13(17)10-7-8-12(16)15(9-10)11-5-3-2-4-6-11;1-2/h2-9H,1H3,(H,14,17);1-2H3
InChIKeyXGOQRRQSJHFAQC-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.22
Rot. Bonds2

About ethane;N-methyl-6-oxo-1-phenylpyridine-3-carboxamide

ethane;N-methyl-6-oxo-1-phenylpyridine-3-carboxamide (PubChem CID 142575628) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is ethane;N-methyl-6-oxo-1-phenylpyridine-3-carboxamide.

Molecular Properties

Compound Nameethane;N-methyl-6-oxo-1-phenylpyridine-3-carboxamide
PubChem CID142575628
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC Nameethane;N-methyl-6-oxo-1-phenylpyridine-3-carboxamide
SMILESCC.CNC(=O)c1ccc(=O)n(-c2ccccc2)c1
InChIInChI=1S/C13H12N2O2.C2H6/c1-14-13(17)10-7-8-12(16)15(9-10)11-5-3-2-4-6-11;1-2/h2-9H,1H3,(H,14,17);1-2H3
InChIKeyXGOQRRQSJHFAQC-UHFFFAOYSA-N
XLogP2.22
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-(dimethylamino)-3-oxopropyl]-6-oxo-1-phenylpyridine-3-carboxamide
CID 91954804
N-(4-hydroxycyclohexyl)-6-oxo-1-phenylpyridine-3-carboxamide
CID 100815207
N-methyl-2-oxo-1-phenylpyridine-3-carboxamide
CID 143596637
N-methylbenzamide
CID 11954
5-benzyl-1-phenylpyridin-2-one;ethane
CID 90848479
5-[(3S,5S)-3,5-dimethylpiperidine-1-carbonyl]-1-phenylpyridin-2-one
CID 97465061
5-(2-hydroxy-4-methoxybenzoyl)-1-phenylpyridin-2-one
CID 44817921
5-(4-ethylpiperazine-1-carbonyl)-1-phenylpyridin-2-one
CID 91945531
N,4-dimethylbenzamide;ethane;toluene
CID 143677670
1-[2-(benzylamino)-2-oxoethyl]-N-methyl-6-oxopyridine-3-carboxamide
CID 70972239
N-methyl-6-oxo-1-phenylpyrimidine-5-carboxamide
CID 143596490
ethane;N-methylbenzamide;2-methylpropane
CID 161462553

Frequently Asked Questions

What is the IUPAC name of ethane;N-methyl-6-oxo-1-phenylpyridine-3-carboxamide?
The IUPAC name of ethane;N-methyl-6-oxo-1-phenylpyridine-3-carboxamide (CID 142575628) is ethane;N-methyl-6-oxo-1-phenylpyridine-3-carboxamide.
What is the SMILES notation for ethane;N-methyl-6-oxo-1-phenylpyridine-3-carboxamide?
The canonical SMILES for ethane;N-methyl-6-oxo-1-phenylpyridine-3-carboxamide is CC.CNC(=O)c1ccc(=O)n(-c2ccccc2)c1.
What is the InChIKey of ethane;N-methyl-6-oxo-1-phenylpyridine-3-carboxamide?
The InChIKey is XGOQRRQSJHFAQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N2O2.C2H6/c1-14-13(17)10-7-8-12(16)15(9-10)11-5-3-2-4-6-11;1-2/h2-9H,1H3,(H,14,17);1-2H3.
What are the key properties of ethane;N-methyl-6-oxo-1-phenylpyridine-3-carboxamide?
ethane;N-methyl-6-oxo-1-phenylpyridine-3-carboxamide has a molecular weight of 258.32 g/mol, XLogP of 2.22, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-methyl-6-oxo-1-phenylpyridine-3-carboxamide is sourced from PubChem (CID 142575628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).