[3-(2-methoxyphenyl)-5-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]-phenylmethanone

C24H22N2O2 — CID 5175604

IUPAC[3-(2-methoxyphenyl)-5-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]-phenylmethanone
SMILESCOc1ccccc1C1CC(c2ccc(C)cc2)=NN1C(=O)c1ccccc1
InChIInChI=1S/C24H22N2O2/c1-17-12-14-18(15-13-17)21-16-22(20-10-6-7-11-23(20)28-2)26(25-21)24(27)19-8-4-3-5-9-19/h3-15,22H,16H2,1-2H3
InChIKeyGRVCKNHJTXXDJF-UHFFFAOYSA-N
MW370.45 g/mol
LogP5.00
Rot. Bonds4

About [3-(2-methoxyphenyl)-5-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]-phenylmethanone

[3-(2-methoxyphenyl)-5-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]-phenylmethanone (PubChem CID 5175604) has the molecular formula C24H22N2O2 and a molecular weight of 370.45 g/mol. Its IUPAC name is [3-(2-methoxyphenyl)-5-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]-phenylmethanone.

Molecular Properties

Compound Name[3-(2-methoxyphenyl)-5-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]-phenylmethanone
PubChem CID5175604
Molecular FormulaC24H22N2O2
Molecular Weight370.45 g/mol
Exact Mass370.17
IUPAC Name[3-(2-methoxyphenyl)-5-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]-phenylmethanone
SMILESCOc1ccccc1C1CC(c2ccc(C)cc2)=NN1C(=O)c1ccccc1
InChIInChI=1S/C24H22N2O2/c1-17-12-14-18(15-13-17)21-16-22(20-10-6-7-11-23(20)28-2)26(25-21)24(27)19-8-4-3-5-9-19/h3-15,22H,16H2,1-2H3
InChIKeyGRVCKNHJTXXDJF-UHFFFAOYSA-N
XLogP5.00
TPSA41.90 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.45
LogP ≤ 55.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze [3-(2-methoxyphenyl)-5-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]-phenylmethanone with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [3-(2-methoxyphenyl)-5-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]-phenylmethanone?
The IUPAC name of [3-(2-methoxyphenyl)-5-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]-phenylmethanone (CID 5175604) is [3-(2-methoxyphenyl)-5-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]-phenylmethanone.
What is the SMILES notation for [3-(2-methoxyphenyl)-5-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]-phenylmethanone?
The canonical SMILES for [3-(2-methoxyphenyl)-5-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]-phenylmethanone is COc1ccccc1C1CC(c2ccc(C)cc2)=NN1C(=O)c1ccccc1.
What is the InChIKey of [3-(2-methoxyphenyl)-5-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]-phenylmethanone?
The InChIKey is GRVCKNHJTXXDJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22N2O2/c1-17-12-14-18(15-13-17)21-16-22(20-10-6-7-11-23(20)28-2)26(25-21)24(27)19-8-4-3-5-9-19/h3-15,22H,16H2,1-2H3.
What are the key properties of [3-(2-methoxyphenyl)-5-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]-phenylmethanone?
[3-(2-methoxyphenyl)-5-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]-phenylmethanone has a molecular weight of 370.45 g/mol, XLogP of 5.00, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(2-methoxyphenyl)-5-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]-phenylmethanone is sourced from PubChem (CID 5175604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).