1-cyclopentyl-3-phenylurea

C12H16N2O — CID 25740

IUPAC1-cyclopentyl-3-phenylurea
SMILESO=C(Nc1ccccc1)NC1CCCC1
InChIInChI=1S/C12H16N2O/c15-12(14-11-8-4-5-9-11)13-10-6-2-1-3-7-10/h1-3,6-7,11H,4-5,8-9H2,(H2,13,14,15)
InChIKeyKODZEKGCUPWVLU-UHFFFAOYSA-N
MW204.27 g/mol
LogP2.75
Rot. Bonds2

About 1-cyclopentyl-3-phenylurea

1-cyclopentyl-3-phenylurea (PubChem CID 25740) has the molecular formula C12H16N2O and a molecular weight of 204.27 g/mol. Its IUPAC name is 1-cyclopentyl-3-phenylurea.

Molecular Properties

Compound Name1-cyclopentyl-3-phenylurea
PubChem CID25740
Molecular FormulaC12H16N2O
Molecular Weight204.27 g/mol
Exact Mass204.13
IUPAC Name1-cyclopentyl-3-phenylurea
SMILESO=C(Nc1ccccc1)NC1CCCC1
InChIInChI=1S/C12H16N2O/c15-12(14-11-8-4-5-9-11)13-10-6-2-1-3-7-10/h1-3,6-7,11H,4-5,8-9H2,(H2,13,14,15)
InChIKeyKODZEKGCUPWVLU-UHFFFAOYSA-N
XLogP2.75
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.27
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Analyze 1-cyclopentyl-3-phenylurea 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

Siduron
CID 16116
Carbanilide
CID 7595
Fenuron
CID 7560
Phenylurea
CID 6145
Centralite
CID 6828
Urea, N-(1-methylethyl)-N'-phenyl-
CID 29852
N-Methyl-N',N'-diphenylurea
CID 25711
1-Methyl-3-phenylurea
CID 13880
1,1-Dimethyl-3-(4-fluorophenyl)urea
CID 9514
1,3-Dimethyl-1,3-diphenylurea
CID 11917
1-(3-Chlorophenyl)-3-cyclohexylurea
CID 751320
N-phenylpyrrolidine-1-carboxamide
CID 791811

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-3-phenylurea?
The IUPAC name of 1-cyclopentyl-3-phenylurea (CID 25740) is 1-cyclopentyl-3-phenylurea.
What is the SMILES notation for 1-cyclopentyl-3-phenylurea?
The canonical SMILES for 1-cyclopentyl-3-phenylurea is O=C(Nc1ccccc1)NC1CCCC1.
What is the InChIKey of 1-cyclopentyl-3-phenylurea?
The InChIKey is KODZEKGCUPWVLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O/c15-12(14-11-8-4-5-9-11)13-10-6-2-1-3-7-10/h1-3,6-7,11H,4-5,8-9H2,(H2,13,14,15).
What are the key properties of 1-cyclopentyl-3-phenylurea?
1-cyclopentyl-3-phenylurea has a molecular weight of 204.27 g/mol, XLogP of 2.75, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-3-phenylurea is sourced from PubChem (CID 25740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).