2-methyl-6-(2-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)-3-phenylpyrimidin-4-one

C19H19N5O — CID 166284104

IUPAC2-methyl-6-(2-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)-3-phenylpyrimidin-4-one
SMILESCc1ncc2c(n1)CCN(c1cc(=O)n(-c3ccccc3)c(C)n1)C2
InChIInChI=1S/C19H19N5O/c1-13-20-11-15-12-23(9-8-17(15)21-13)18-10-19(25)24(14(2)22-18)16-6-4-3-5-7-16/h3-7,10-11H,8-9,12H2,1-2H3
InChIKeyZRHXKNKFTDOSES-UHFFFAOYSA-N
MW333.40 g/mol
LogP2.20
Rot. Bonds2

About 2-methyl-6-(2-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)-3-phenylpyrimidin-4-one

2-methyl-6-(2-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)-3-phenylpyrimidin-4-one (PubChem CID 166284104) has the molecular formula C19H19N5O and a molecular weight of 333.40 g/mol. Its IUPAC name is 2-methyl-6-(2-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)-3-phenylpyrimidin-4-one.

Molecular Properties

Compound Name2-methyl-6-(2-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)-3-phenylpyrimidin-4-one
PubChem CID166284104
Molecular FormulaC19H19N5O
Molecular Weight333.40 g/mol
Exact Mass333.16
IUPAC Name2-methyl-6-(2-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)-3-phenylpyrimidin-4-one
SMILESCc1ncc2c(n1)CCN(c1cc(=O)n(-c3ccccc3)c(C)n1)C2
InChIInChI=1S/C19H19N5O/c1-13-20-11-15-12-23(9-8-17(15)21-13)18-10-19(25)24(14(2)22-18)16-6-4-3-5-7-16/h3-7,10-11H,8-9,12H2,1-2H3
InChIKeyZRHXKNKFTDOSES-UHFFFAOYSA-N
XLogP2.20
TPSA63.91 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.40
LogP ≤ 52.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 2-methyl-6-(2-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)-3-phenylpyrimidin-4-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

2,6-dimethyl-3-phenylpyrimidin-4-one
CID 608225
6-[(3S,4S)-4-amino-3-methyl-2-oxa-8-azaspiro[4.5]decan-8-yl]-2-methyl-3-phenylpyrimidin-4-one
CID 155165157
2-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-amine
CID 123594132
6-[(2,6-dimethylphenyl)methyl]-2-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
CID 24928986
3-methyl-4-(2-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)butanoic acid
CID 126630237
2,3-diphenyl-6-piperidin-1-ylpyrimidin-4-one
CID 15632926
3-(2,3-dichlorophenyl)-2-methyl-6-(4-oxopiperidin-1-yl)pyrimidin-4-one
CID 155165313
1-[2-(2-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)-4-pyridinyl]-2-(4-propan-2-ylphenyl)ethanone
CID 159562255
1-[6-(2-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)-2-pyridinyl]-2-[3-(trifluoromethyl)phenyl]ethanone;sulfur monoxide
CID 157163319
6-(1H-indol-2-ylmethyl)-2-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine
CID 24912897
2-[2-[(2-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)methyl]pyrrol-1-yl]acetic acid
CID 24917852
N'-(6-phenyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-2-yl)ethane-1,2-diamine
CID 106821023

Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-(2-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)-3-phenylpyrimidin-4-one?
The IUPAC name of 2-methyl-6-(2-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)-3-phenylpyrimidin-4-one (CID 166284104) is 2-methyl-6-(2-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)-3-phenylpyrimidin-4-one.
What is the SMILES notation for 2-methyl-6-(2-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)-3-phenylpyrimidin-4-one?
The canonical SMILES for 2-methyl-6-(2-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)-3-phenylpyrimidin-4-one is Cc1ncc2c(n1)CCN(c1cc(=O)n(-c3ccccc3)c(C)n1)C2.
What is the InChIKey of 2-methyl-6-(2-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)-3-phenylpyrimidin-4-one?
The InChIKey is ZRHXKNKFTDOSES-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N5O/c1-13-20-11-15-12-23(9-8-17(15)21-13)18-10-19(25)24(14(2)22-18)16-6-4-3-5-7-16/h3-7,10-11H,8-9,12H2,1-2H3.
What are the key properties of 2-methyl-6-(2-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)-3-phenylpyrimidin-4-one?
2-methyl-6-(2-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)-3-phenylpyrimidin-4-one has a molecular weight of 333.40 g/mol, XLogP of 2.20, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-(2-methyl-7,8-dihydro-5H-pyrido[4,3-d]pyrimidin-6-yl)-3-phenylpyrimidin-4-one is sourced from PubChem (CID 166284104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).