2-(4-methylphenyl)-1-[(4-methylphenyl)methyl]pyridin-4-one

C20H19NO — CID 122663092

IUPAC2-(4-methylphenyl)-1-[(4-methylphenyl)methyl]pyridin-4-one
SMILESCc1ccc(Cn2ccc(=O)cc2-c2ccc(C)cc2)cc1
InChIInChI=1S/C20H19NO/c1-15-3-7-17(8-4-15)14-21-12-11-19(22)13-20(21)18-9-5-16(2)6-10-18/h3-13H,14H2,1-2H3
InChIKeyDDNDXJSMBSDNGZ-UHFFFAOYSA-N
MW289.38 g/mol
LogP4.18
Rot. Bonds3

About 2-(4-methylphenyl)-1-[(4-methylphenyl)methyl]pyridin-4-one

2-(4-methylphenyl)-1-[(4-methylphenyl)methyl]pyridin-4-one (PubChem CID 122663092) has the molecular formula C20H19NO and a molecular weight of 289.38 g/mol. Its IUPAC name is 2-(4-methylphenyl)-1-[(4-methylphenyl)methyl]pyridin-4-one.

Molecular Properties

Compound Name2-(4-methylphenyl)-1-[(4-methylphenyl)methyl]pyridin-4-one
PubChem CID122663092
Molecular FormulaC20H19NO
Molecular Weight289.38 g/mol
Exact Mass289.15
IUPAC Name2-(4-methylphenyl)-1-[(4-methylphenyl)methyl]pyridin-4-one
SMILESCc1ccc(Cn2ccc(=O)cc2-c2ccc(C)cc2)cc1
InChIInChI=1S/C20H19NO/c1-15-3-7-17(8-4-15)14-21-12-11-19(22)13-20(21)18-9-5-16(2)6-10-18/h3-13H,14H2,1-2H3
InChIKeyDDNDXJSMBSDNGZ-UHFFFAOYSA-N
XLogP4.18
TPSA22.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 54.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-chlorophenyl)-1-[(4-methylphenyl)methyl]pyridin-4-one
CID 122663097
1-benzyl-2-methylpyridin-4-one
CID 154013206
3-hydroxy-2-methyl-1-[(4-methylphenyl)methyl]pyridin-4-one
CID 10561391
1-[(4-fluorophenyl)methyl]-4-[(4-methylphenyl)methyl]pyrazine-2,3-dione
CID 22520207
3-bromo-1-[(4-methylphenyl)methyl]-4-phenylmethoxypyridin-2-one
CID 10287295
1-[(4-aminophenyl)methyl]-4-methylpyridin-2-one
CID 62962113
[1-[(4-methylphenyl)methyl]indol-6-yl]methanol
CID 28886893
6-fluoro-1-[(4-methylphenyl)methyl]indole
CID 22256864
1-[[4-(4-methylphenyl)phenyl]methyl]-6,7-dihydro-5H-pyrrolo[2,3-c]azepine-4,8-dione
CID 46946014
[4-[(4-methyl-2-oxo-1-pyridinyl)methyl]phenyl]boronic acid
CID 62962134
2-[4-[(4-methyl-2-oxo-1-pyridinyl)methyl]phenyl]acetic acid
CID 68750620
7-chloro-3-[(4-methylphenyl)methyl]quinazolin-4-one
CID 853041

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylphenyl)-1-[(4-methylphenyl)methyl]pyridin-4-one?
The IUPAC name of 2-(4-methylphenyl)-1-[(4-methylphenyl)methyl]pyridin-4-one (CID 122663092) is 2-(4-methylphenyl)-1-[(4-methylphenyl)methyl]pyridin-4-one.
What is the SMILES notation for 2-(4-methylphenyl)-1-[(4-methylphenyl)methyl]pyridin-4-one?
The canonical SMILES for 2-(4-methylphenyl)-1-[(4-methylphenyl)methyl]pyridin-4-one is Cc1ccc(Cn2ccc(=O)cc2-c2ccc(C)cc2)cc1.
What is the InChIKey of 2-(4-methylphenyl)-1-[(4-methylphenyl)methyl]pyridin-4-one?
The InChIKey is DDNDXJSMBSDNGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19NO/c1-15-3-7-17(8-4-15)14-21-12-11-19(22)13-20(21)18-9-5-16(2)6-10-18/h3-13H,14H2,1-2H3.
What are the key properties of 2-(4-methylphenyl)-1-[(4-methylphenyl)methyl]pyridin-4-one?
2-(4-methylphenyl)-1-[(4-methylphenyl)methyl]pyridin-4-one has a molecular weight of 289.38 g/mol, XLogP of 4.18, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylphenyl)-1-[(4-methylphenyl)methyl]pyridin-4-one is sourced from PubChem (CID 122663092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).