2-(2-methoxyphenyl)-1-pyrimidin-2-ylquinolin-4-one

C20H15N3O2 — CID 166443880

IUPAC2-(2-methoxyphenyl)-1-pyrimidin-2-ylquinolin-4-one
SMILESCOc1ccccc1-c1cc(=O)c2ccccc2n1-c1ncccn1
InChIInChI=1S/C20H15N3O2/c1-25-19-10-5-3-8-15(19)17-13-18(24)14-7-2-4-9-16(14)23(17)20-21-11-6-12-22-20/h2-13H,1H3
InChIKeyIEWUQMBCCICUNX-UHFFFAOYSA-N
MW329.36 g/mol
LogP3.46
Rot. Bonds3

About 2-(2-methoxyphenyl)-1-pyrimidin-2-ylquinolin-4-one

2-(2-methoxyphenyl)-1-pyrimidin-2-ylquinolin-4-one (PubChem CID 166443880) has the molecular formula C20H15N3O2 and a molecular weight of 329.36 g/mol. Its IUPAC name is 2-(2-methoxyphenyl)-1-pyrimidin-2-ylquinolin-4-one.

Molecular Properties

Compound Name2-(2-methoxyphenyl)-1-pyrimidin-2-ylquinolin-4-one
PubChem CID166443880
Molecular FormulaC20H15N3O2
Molecular Weight329.36 g/mol
Exact Mass329.12
IUPAC Name2-(2-methoxyphenyl)-1-pyrimidin-2-ylquinolin-4-one
SMILESCOc1ccccc1-c1cc(=O)c2ccccc2n1-c1ncccn1
InChIInChI=1S/C20H15N3O2/c1-25-19-10-5-3-8-15(19)17-13-18(24)14-7-2-4-9-16(14)23(17)20-21-11-6-12-22-20/h2-13H,1H3
InChIKeyIEWUQMBCCICUNX-UHFFFAOYSA-N
XLogP3.46
TPSA57.01 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.36
LogP ≤ 53.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 2-(2-methoxyphenyl)-1-pyrimidin-2-ylquinolin-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

10-(2-methoxyphenyl)-1-azatricyclo[6.1.1.02,7]deca-2,4,6,8(10)-tetraen-9-one
CID 67595885
2-[(E)-3-methylbut-1-enyl]-1-pyrimidin-2-ylquinolin-4-one
CID 166443866
4-methoxy-2-methyl-1-pyridin-2-ylindole
CID 170694384
ethane;5-phenyl-11-pyrimidin-2-ylindolo[3,2-b]carbazole
CID 123300627
9-(2,6-dimethoxyphenyl)carbazole
CID 58050238
N-butyl-4-methoxy-1-pyrimidin-2-ylindole-2-carboxamide
CID 122377454
3-(2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridine
CID 141182116
6-(2-methoxyphenyl)-4-phenyl-3,7,8,10-tetrazatricyclo[7.4.0.02,7]trideca-1,3,5,8,10,12-hexaene
CID 134695196
2-[3-chloro-5-(2-methoxyphenyl)-1,2,4-triazol-1-yl]pyrimidine
CID 30032947
8-(2-methoxyphenyl)-17-(9-phenylcarbazol-3-yl)-14,17-diazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(10),2,4,6,8,11(16),12,14-octaene
CID 145354139
3-[9-(9-phenylcarbazol-3-yl)carbazol-3-yl]-9-pyrimidin-2-ylcarbazole
CID 118487712
10,10-dimethyl-5-pyrimidin-2-ylindeno[1,2-b]indole
CID 121298587

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyphenyl)-1-pyrimidin-2-ylquinolin-4-one?
The IUPAC name of 2-(2-methoxyphenyl)-1-pyrimidin-2-ylquinolin-4-one (CID 166443880) is 2-(2-methoxyphenyl)-1-pyrimidin-2-ylquinolin-4-one.
What is the SMILES notation for 2-(2-methoxyphenyl)-1-pyrimidin-2-ylquinolin-4-one?
The canonical SMILES for 2-(2-methoxyphenyl)-1-pyrimidin-2-ylquinolin-4-one is COc1ccccc1-c1cc(=O)c2ccccc2n1-c1ncccn1.
What is the InChIKey of 2-(2-methoxyphenyl)-1-pyrimidin-2-ylquinolin-4-one?
The InChIKey is IEWUQMBCCICUNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15N3O2/c1-25-19-10-5-3-8-15(19)17-13-18(24)14-7-2-4-9-16(14)23(17)20-21-11-6-12-22-20/h2-13H,1H3.
What are the key properties of 2-(2-methoxyphenyl)-1-pyrimidin-2-ylquinolin-4-one?
2-(2-methoxyphenyl)-1-pyrimidin-2-ylquinolin-4-one has a molecular weight of 329.36 g/mol, XLogP of 3.46, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyphenyl)-1-pyrimidin-2-ylquinolin-4-one is sourced from PubChem (CID 166443880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).