2-methyl-5-(methylaminomethyl)-1-phenylpyridin-4-one

C14H16N2O — CID 82419740

IUPAC2-methyl-5-(methylaminomethyl)-1-phenylpyridin-4-one
SMILESCNCc1cn(-c2ccccc2)c(C)cc1=O
InChIInChI=1S/C14H16N2O/c1-11-8-14(17)12(9-15-2)10-16(11)13-6-4-3-5-7-13/h3-8,10,15H,9H2,1-2H3
InChIKeyBWLGIQIOZBBSKS-UHFFFAOYSA-N
MW228.30 g/mol
LogP1.87
Rot. Bonds3

About 2-methyl-5-(methylaminomethyl)-1-phenylpyridin-4-one

2-methyl-5-(methylaminomethyl)-1-phenylpyridin-4-one (PubChem CID 82419740) has the molecular formula C14H16N2O and a molecular weight of 228.30 g/mol. Its IUPAC name is 2-methyl-5-(methylaminomethyl)-1-phenylpyridin-4-one.

Molecular Properties

Compound Name2-methyl-5-(methylaminomethyl)-1-phenylpyridin-4-one
PubChem CID82419740
Molecular FormulaC14H16N2O
Molecular Weight228.30 g/mol
Exact Mass228.13
IUPAC Name2-methyl-5-(methylaminomethyl)-1-phenylpyridin-4-one
SMILESCNCc1cn(-c2ccccc2)c(C)cc1=O
InChIInChI=1S/C14H16N2O/c1-11-8-14(17)12(9-15-2)10-16(11)13-6-4-3-5-7-13/h3-8,10,15H,9H2,1-2H3
InChIKeyBWLGIQIOZBBSKS-UHFFFAOYSA-N
XLogP1.87
TPSA34.03 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.30
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-5-(methylaminomethyl)-1-(4-methylphenyl)pyridin-4-one
CID 82419104
5-(ethylaminomethyl)-2-methyl-1-phenylpyridin-4-one
CID 82419741
2-(6-methyl-4-oxo-1-phenyl-3-pyridinyl)acetic acid
CID 82419755
1-(4-ethoxyphenyl)-2-methyl-5-(methylaminomethyl)pyridin-4-one
CID 82420006
1-(2,4-dimethoxyphenyl)-2-methyl-5-(methylaminomethyl)pyridin-4-one
CID 82422073
1-(4-ethylphenyl)-2-methyl-5-[(2-methylpropylamino)methyl]pyridin-4-one
CID 82421084
1-(4-ethoxyphenyl)-5-(ethylaminomethyl)-2-methylpyridin-4-one
CID 82420007
1-(4-fluorophenyl)-2-methyl-5-[(2-methylpropylamino)methyl]pyridin-4-one
CID 82421850
1-(2,5-dimethyl-1-phenylpyrrol-3-yl)-N-methylmethanamine
CID 43090175
5-(chloromethyl)-1-(4-fluorophenyl)-2-methylpyridin-4-one
CID 82421856
5-(butylaminomethyl)-1-(3,4-dimethylphenyl)-2-methylpyridin-4-one
CID 82421165
5-(hydroxymethyl)-1-(3-methoxyphenyl)-2-methylpyridin-4-one
CID 82420995

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-(methylaminomethyl)-1-phenylpyridin-4-one?
The IUPAC name of 2-methyl-5-(methylaminomethyl)-1-phenylpyridin-4-one (CID 82419740) is 2-methyl-5-(methylaminomethyl)-1-phenylpyridin-4-one.
What is the SMILES notation for 2-methyl-5-(methylaminomethyl)-1-phenylpyridin-4-one?
The canonical SMILES for 2-methyl-5-(methylaminomethyl)-1-phenylpyridin-4-one is CNCc1cn(-c2ccccc2)c(C)cc1=O.
What is the InChIKey of 2-methyl-5-(methylaminomethyl)-1-phenylpyridin-4-one?
The InChIKey is BWLGIQIOZBBSKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O/c1-11-8-14(17)12(9-15-2)10-16(11)13-6-4-3-5-7-13/h3-8,10,15H,9H2,1-2H3.
What are the key properties of 2-methyl-5-(methylaminomethyl)-1-phenylpyridin-4-one?
2-methyl-5-(methylaminomethyl)-1-phenylpyridin-4-one has a molecular weight of 228.30 g/mol, XLogP of 1.87, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-(methylaminomethyl)-1-phenylpyridin-4-one is sourced from PubChem (CID 82419740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).