6-(2-hydroxy-5-methylbenzoyl)-3-methyl-1,4-dihydropyrido[2,3-d]pyrimidin-2-one

C16H15N3O3 — CID 2077864

IUPAC6-(2-hydroxy-5-methylbenzoyl)-3-methyl-1,4-dihydropyrido[2,3-d]pyrimidin-2-one
SMILESCc1ccc(O)c(C(=O)c2cnc3c(c2)CN(C)C(=O)N3)c1
InChIInChI=1S/C16H15N3O3/c1-9-3-4-13(20)12(5-9)14(21)10-6-11-8-19(2)16(22)18-15(11)17-7-10/h3-7,20H,8H2,1-2H3,(H,17,18,22)
InChIKeyDEZUFYGDHPJGOZ-UHFFFAOYSA-N
MW297.31 g/mol
LogP2.30
Rot. Bonds2

About 6-(2-hydroxy-5-methylbenzoyl)-3-methyl-1,4-dihydropyrido[2,3-d]pyrimidin-2-one

6-(2-hydroxy-5-methylbenzoyl)-3-methyl-1,4-dihydropyrido[2,3-d]pyrimidin-2-one (PubChem CID 2077864) has the molecular formula C16H15N3O3 and a molecular weight of 297.31 g/mol. Its IUPAC name is 6-(2-hydroxy-5-methylbenzoyl)-3-methyl-1,4-dihydropyrido[2,3-d]pyrimidin-2-one.

Molecular Properties

Compound Name6-(2-hydroxy-5-methylbenzoyl)-3-methyl-1,4-dihydropyrido[2,3-d]pyrimidin-2-one
PubChem CID2077864
Molecular FormulaC16H15N3O3
Molecular Weight297.31 g/mol
Exact Mass297.11
IUPAC Name6-(2-hydroxy-5-methylbenzoyl)-3-methyl-1,4-dihydropyrido[2,3-d]pyrimidin-2-one
SMILESCc1ccc(O)c(C(=O)c2cnc3c(c2)CN(C)C(=O)N3)c1
InChIInChI=1S/C16H15N3O3/c1-9-3-4-13(20)12(5-9)14(21)10-6-11-8-19(2)16(22)18-15(11)17-7-10/h3-7,20H,8H2,1-2H3,(H,17,18,22)
InChIKeyDEZUFYGDHPJGOZ-UHFFFAOYSA-N
XLogP2.30
TPSA82.53 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.31
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 6-(2-hydroxy-5-methylbenzoyl)-3-methyl-1,4-dihydropyrido[2,3-d]pyrimidin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

CID 46914575
CID 46914575
CID 2077855
CID 2077855
CID 2102154
CID 2102154
CID 2110953
CID 2110953
CID 2117624
CID 2117624
CID 2537541
CID 2537541
CID 2537623
CID 2537623
CID 4969413
CID 4969413
CID 11131952
CID 11131952
CID 2077861
CID 2077861
CID 2116212
CID 2116212
CID 71010115
CID 71010115

Frequently Asked Questions

What is the IUPAC name of 6-(2-hydroxy-5-methylbenzoyl)-3-methyl-1,4-dihydropyrido[2,3-d]pyrimidin-2-one?
The IUPAC name of 6-(2-hydroxy-5-methylbenzoyl)-3-methyl-1,4-dihydropyrido[2,3-d]pyrimidin-2-one (CID 2077864) is 6-(2-hydroxy-5-methylbenzoyl)-3-methyl-1,4-dihydropyrido[2,3-d]pyrimidin-2-one.
What is the SMILES notation for 6-(2-hydroxy-5-methylbenzoyl)-3-methyl-1,4-dihydropyrido[2,3-d]pyrimidin-2-one?
The canonical SMILES for 6-(2-hydroxy-5-methylbenzoyl)-3-methyl-1,4-dihydropyrido[2,3-d]pyrimidin-2-one is Cc1ccc(O)c(C(=O)c2cnc3c(c2)CN(C)C(=O)N3)c1.
What is the InChIKey of 6-(2-hydroxy-5-methylbenzoyl)-3-methyl-1,4-dihydropyrido[2,3-d]pyrimidin-2-one?
The InChIKey is DEZUFYGDHPJGOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N3O3/c1-9-3-4-13(20)12(5-9)14(21)10-6-11-8-19(2)16(22)18-15(11)17-7-10/h3-7,20H,8H2,1-2H3,(H,17,18,22).
What are the key properties of 6-(2-hydroxy-5-methylbenzoyl)-3-methyl-1,4-dihydropyrido[2,3-d]pyrimidin-2-one?
6-(2-hydroxy-5-methylbenzoyl)-3-methyl-1,4-dihydropyrido[2,3-d]pyrimidin-2-one has a molecular weight of 297.31 g/mol, XLogP of 2.30, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-hydroxy-5-methylbenzoyl)-3-methyl-1,4-dihydropyrido[2,3-d]pyrimidin-2-one is sourced from PubChem (CID 2077864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).