5-hydroxy-2-methyl-1-[(4-phenylphenyl)methyl]pyridin-4-one

C19H17NO2 — CID 130423208

IUPAC5-hydroxy-2-methyl-1-[(4-phenylphenyl)methyl]pyridin-4-one
SMILESCc1cc(=O)c(O)cn1Cc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C19H17NO2/c1-14-11-18(21)19(22)13-20(14)12-15-7-9-17(10-8-15)16-5-3-2-4-6-16/h2-11,13,22H,12H2,1H3
InChIKeyMQQDBYBTAKWKRT-UHFFFAOYSA-N
MW291.35 g/mol
LogP3.58
Rot. Bonds3

About 5-hydroxy-2-methyl-1-[(4-phenylphenyl)methyl]pyridin-4-one

5-hydroxy-2-methyl-1-[(4-phenylphenyl)methyl]pyridin-4-one (PubChem CID 130423208) has the molecular formula C19H17NO2 and a molecular weight of 291.35 g/mol. Its IUPAC name is 5-hydroxy-2-methyl-1-[(4-phenylphenyl)methyl]pyridin-4-one.

Molecular Properties

Compound Name5-hydroxy-2-methyl-1-[(4-phenylphenyl)methyl]pyridin-4-one
PubChem CID130423208
Molecular FormulaC19H17NO2
Molecular Weight291.35 g/mol
Exact Mass291.13
IUPAC Name5-hydroxy-2-methyl-1-[(4-phenylphenyl)methyl]pyridin-4-one
SMILESCc1cc(=O)c(O)cn1Cc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C19H17NO2/c1-14-11-18(21)19(22)13-20(14)12-15-7-9-17(10-8-15)16-5-3-2-4-6-16/h2-11,13,22H,12H2,1H3
InChIKeyMQQDBYBTAKWKRT-UHFFFAOYSA-N
XLogP3.58
TPSA42.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-2-methyl-1-[(4-phenylphenyl)methyl]pyridin-4-one?
The IUPAC name of 5-hydroxy-2-methyl-1-[(4-phenylphenyl)methyl]pyridin-4-one (CID 130423208) is 5-hydroxy-2-methyl-1-[(4-phenylphenyl)methyl]pyridin-4-one.
What is the SMILES notation for 5-hydroxy-2-methyl-1-[(4-phenylphenyl)methyl]pyridin-4-one?
The canonical SMILES for 5-hydroxy-2-methyl-1-[(4-phenylphenyl)methyl]pyridin-4-one is Cc1cc(=O)c(O)cn1Cc1ccc(-c2ccccc2)cc1.
What is the InChIKey of 5-hydroxy-2-methyl-1-[(4-phenylphenyl)methyl]pyridin-4-one?
The InChIKey is MQQDBYBTAKWKRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17NO2/c1-14-11-18(21)19(22)13-20(14)12-15-7-9-17(10-8-15)16-5-3-2-4-6-16/h2-11,13,22H,12H2,1H3.
What are the key properties of 5-hydroxy-2-methyl-1-[(4-phenylphenyl)methyl]pyridin-4-one?
5-hydroxy-2-methyl-1-[(4-phenylphenyl)methyl]pyridin-4-one has a molecular weight of 291.35 g/mol, XLogP of 3.58, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-2-methyl-1-[(4-phenylphenyl)methyl]pyridin-4-one is sourced from PubChem (CID 130423208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).