1-cyclopropyl-3-[2-(3-methylphenyl)-2-oxoethyl]imidazol-2-one

C15H16N2O2 — CID 80581515

IUPAC1-cyclopropyl-3-[2-(3-methylphenyl)-2-oxoethyl]imidazol-2-one
SMILESCc1cccc(C(=O)Cn2ccn(C3CC3)c2=O)c1
InChIInChI=1S/C15H16N2O2/c1-11-3-2-4-12(9-11)14(18)10-16-7-8-17(15(16)19)13-5-6-13/h2-4,7-9,13H,5-6,10H2,1H3
InChIKeyGYZVZZDPUSHZNK-UHFFFAOYSA-N
MW256.30 g/mol
LogP2.18
Rot. Bonds4

About 1-cyclopropyl-3-[2-(3-methylphenyl)-2-oxoethyl]imidazol-2-one

1-cyclopropyl-3-[2-(3-methylphenyl)-2-oxoethyl]imidazol-2-one (PubChem CID 80581515) has the molecular formula C15H16N2O2 and a molecular weight of 256.30 g/mol. Its IUPAC name is 1-cyclopropyl-3-[2-(3-methylphenyl)-2-oxoethyl]imidazol-2-one.

Molecular Properties

Compound Name1-cyclopropyl-3-[2-(3-methylphenyl)-2-oxoethyl]imidazol-2-one
PubChem CID80581515
Molecular FormulaC15H16N2O2
Molecular Weight256.30 g/mol
Exact Mass256.12
IUPAC Name1-cyclopropyl-3-[2-(3-methylphenyl)-2-oxoethyl]imidazol-2-one
SMILESCc1cccc(C(=O)Cn2ccn(C3CC3)c2=O)c1
InChIInChI=1S/C15H16N2O2/c1-11-3-2-4-12(9-11)14(18)10-16-7-8-17(15(16)19)13-5-6-13/h2-4,7-9,13H,5-6,10H2,1H3
InChIKeyGYZVZZDPUSHZNK-UHFFFAOYSA-N
XLogP2.18
TPSA44.00 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.30
LogP ≤ 52.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-cyclopropyl-3-[2-(3-methylphenyl)-2-oxoethyl]imidazol-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

1-[2-(3-chlorophenyl)-2-oxoethyl]-3-ethylimidazol-2-one
CID 80580912
1-(3-methylphenyl)-2-(2-methylpiperidin-1-yl)ethanone
CID 43794417
4,4-dimethyl-1-[2-(3-methylphenyl)-2-oxoethyl]piperidine-2,6-dione
CID 62934469
2-[2-(hydroxymethyl)pyrrolidin-1-yl]-1-(3-methylphenyl)ethanone
CID 62035550
1-(3-methylphenyl)-2-(2-propan-2-ylimidazol-1-yl)ethanone
CID 43797826
5-chloro-1-[2-(3-methylphenyl)-2-oxoethyl]pyrimidine-2,4-dione
CID 66424169
5-fluoro-1-[2-(3-methylphenyl)-2-oxoethyl]pyrimidine-2,4-dione
CID 63558385
N-butyl-2-(3-cyclopropyl-2-oxoimidazol-1-yl)acetamide
CID 116625281
1-cyclopropyl-3-(2-ethylbutyl)imidazol-2-one
CID 116625467
4-[2-(3-methylphenyl)-2-oxoethyl]piperazin-2-one
CID 62052117
1-cyclopropyl-3-[2-hydroxy-2-(4-propan-2-ylphenyl)ethyl]imidazol-2-one
CID 80580650
1-[4-(4-bromophenyl)-4-oxobutyl]-3-cyclopropylimidazol-2-one
CID 80579906

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-3-[2-(3-methylphenyl)-2-oxoethyl]imidazol-2-one?
The IUPAC name of 1-cyclopropyl-3-[2-(3-methylphenyl)-2-oxoethyl]imidazol-2-one (CID 80581515) is 1-cyclopropyl-3-[2-(3-methylphenyl)-2-oxoethyl]imidazol-2-one.
What is the SMILES notation for 1-cyclopropyl-3-[2-(3-methylphenyl)-2-oxoethyl]imidazol-2-one?
The canonical SMILES for 1-cyclopropyl-3-[2-(3-methylphenyl)-2-oxoethyl]imidazol-2-one is Cc1cccc(C(=O)Cn2ccn(C3CC3)c2=O)c1.
What is the InChIKey of 1-cyclopropyl-3-[2-(3-methylphenyl)-2-oxoethyl]imidazol-2-one?
The InChIKey is GYZVZZDPUSHZNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2/c1-11-3-2-4-12(9-11)14(18)10-16-7-8-17(15(16)19)13-5-6-13/h2-4,7-9,13H,5-6,10H2,1H3.
What are the key properties of 1-cyclopropyl-3-[2-(3-methylphenyl)-2-oxoethyl]imidazol-2-one?
1-cyclopropyl-3-[2-(3-methylphenyl)-2-oxoethyl]imidazol-2-one has a molecular weight of 256.30 g/mol, XLogP of 2.18, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-3-[2-(3-methylphenyl)-2-oxoethyl]imidazol-2-one is sourced from PubChem (CID 80581515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).