5-amino-1-(2-chlorophenyl)-2-methylpyridin-4-one

C12H11ClN2O — CID 82467411

IUPAC5-amino-1-(2-chlorophenyl)-2-methylpyridin-4-one
SMILESCc1cc(=O)c(N)cn1-c1ccccc1Cl
InChIInChI=1S/C12H11ClN2O/c1-8-6-12(16)10(14)7-15(8)11-5-3-2-4-9(11)13/h2-7H,14H2,1H3
InChIKeyUHVRFKLEIQGZRY-UHFFFAOYSA-N
MW234.69 g/mol
LogP2.38
Rot. Bonds1

About 5-amino-1-(2-chlorophenyl)-2-methylpyridin-4-one

5-amino-1-(2-chlorophenyl)-2-methylpyridin-4-one (PubChem CID 82467411) has the molecular formula C12H11ClN2O and a molecular weight of 234.69 g/mol. Its IUPAC name is 5-amino-1-(2-chlorophenyl)-2-methylpyridin-4-one.

Molecular Properties

Compound Name5-amino-1-(2-chlorophenyl)-2-methylpyridin-4-one
PubChem CID82467411
Molecular FormulaC12H11ClN2O
Molecular Weight234.69 g/mol
Exact Mass234.06
IUPAC Name5-amino-1-(2-chlorophenyl)-2-methylpyridin-4-one
SMILESCc1cc(=O)c(N)cn1-c1ccccc1Cl
InChIInChI=1S/C12H11ClN2O/c1-8-6-12(16)10(14)7-15(8)11-5-3-2-4-9(11)13/h2-7H,14H2,1H3
InChIKeyUHVRFKLEIQGZRY-UHFFFAOYSA-N
XLogP2.38
TPSA48.02 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.69
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-amino-1-(2,3-dichlorophenyl)-2-methylpyridin-4-one
CID 82467267
5-amino-1-[2-chloro-5-(trifluoromethyl)phenyl]-2-methylpyridin-4-one
CID 82467328
5-amino-1-(5-chloro-2-methylphenyl)-2-methylpyridin-4-one
CID 82467413
5-amino-1-(2-ethoxyphenyl)-2-methylpyridin-4-one
CID 82467325
3-amino-1-(2-chlorophenyl)-6-methylpyridazin-4-one
CID 14820803
1-(2,3-dichlorophenyl)-6-methyl-4-oxopyridine-3-carbonitrile
CID 82419058
5-(chloromethyl)-1-(2-ethylphenyl)-2-methylpyridin-4-one
CID 82419859
3-(2-chlorophenyl)-1,3-oxazol-2-one
CID 141380770
5-amino-2-(2-chlorophenyl)-1H-pyrazol-3-one
CID 54273790
5-(2-aminopropan-2-yl)-1-(2-ethylphenyl)-2-methylpyridin-4-one
CID 82419866
1-(2-chlorophenyl)-2,5-dimethylpyrrole
CID 4763653
6-methyl-1-(2-methylphenyl)-4-oxopyridine-3-carboxylic acid
CID 82419564

Frequently Asked Questions

What is the IUPAC name of 5-amino-1-(2-chlorophenyl)-2-methylpyridin-4-one?
The IUPAC name of 5-amino-1-(2-chlorophenyl)-2-methylpyridin-4-one (CID 82467411) is 5-amino-1-(2-chlorophenyl)-2-methylpyridin-4-one.
What is the SMILES notation for 5-amino-1-(2-chlorophenyl)-2-methylpyridin-4-one?
The canonical SMILES for 5-amino-1-(2-chlorophenyl)-2-methylpyridin-4-one is Cc1cc(=O)c(N)cn1-c1ccccc1Cl.
What is the InChIKey of 5-amino-1-(2-chlorophenyl)-2-methylpyridin-4-one?
The InChIKey is UHVRFKLEIQGZRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11ClN2O/c1-8-6-12(16)10(14)7-15(8)11-5-3-2-4-9(11)13/h2-7H,14H2,1H3.
What are the key properties of 5-amino-1-(2-chlorophenyl)-2-methylpyridin-4-one?
5-amino-1-(2-chlorophenyl)-2-methylpyridin-4-one has a molecular weight of 234.69 g/mol, XLogP of 2.38, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-1-(2-chlorophenyl)-2-methylpyridin-4-one is sourced from PubChem (CID 82467411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).