1-cyclopentyl-3-(2,2-diphenylethyl)urea

C20H24N2O — CID 38287341

IUPAC1-cyclopentyl-3-(2,2-diphenylethyl)urea
SMILESO=C(NCC(c1ccccc1)c1ccccc1)NC1CCCC1
InChIInChI=1S/C20H24N2O/c23-20(22-18-13-7-8-14-18)21-15-19(16-9-3-1-4-10-16)17-11-5-2-6-12-17/h1-6,9-12,18-19H,7-8,13-15H2,(H2,21,22,23)
InChIKeyZHLZPYQWJHNJBH-UHFFFAOYSA-N
MW308.43 g/mol
LogP4.06
Rot. Bonds5

About 1-cyclopentyl-3-(2,2-diphenylethyl)urea

1-cyclopentyl-3-(2,2-diphenylethyl)urea (PubChem CID 38287341) has the molecular formula C20H24N2O and a molecular weight of 308.43 g/mol. Its IUPAC name is 1-cyclopentyl-3-(2,2-diphenylethyl)urea.

Molecular Properties

Compound Name1-cyclopentyl-3-(2,2-diphenylethyl)urea
PubChem CID38287341
Molecular FormulaC20H24N2O
Molecular Weight308.43 g/mol
Exact Mass308.19
IUPAC Name1-cyclopentyl-3-(2,2-diphenylethyl)urea
SMILESO=C(NCC(c1ccccc1)c1ccccc1)NC1CCCC1
InChIInChI=1S/C20H24N2O/c23-20(22-18-13-7-8-14-18)21-15-19(16-9-3-1-4-10-16)17-11-5-2-6-12-17/h1-6,9-12,18-19H,7-8,13-15H2,(H2,21,22,23)
InChIKeyZHLZPYQWJHNJBH-UHFFFAOYSA-N
XLogP4.06
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.43
LogP ≤ 54.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

1-cyclohexyl-3-(5-hydroxy-3-phenylpentyl)urea
CID 121112417
1-(3-amino-3-phenylpropyl)-3-cyclohexylurea
CID 80506800
3-[[2-(cyclohexylcarbamoylamino)acetyl]amino]-2-phenylpropanoic acid
CID 119254873
1-cyclopropyl-3-(2,3-diphenylpropyl)urea
CID 110307425
1-cyclohexyl-3-[2-(cyclohexylcarbamoylamino)-1,2-diphenylethyl]urea
CID 15231966
1-cyclohexyl-3-[(1S,2S)-2-(cyclohexylcarbamoylamino)-1,2-diphenylethyl]urea
CID 70268253
1-cycloheptyl-3-[2-hydroxy-2-(3-hydroxyphenyl)ethyl]urea
CID 119060582
1-(4-hydroxycyclohexyl)-3-(2-phenyl-2-pyrrolidin-1-ylethyl)urea
CID 110892520
1-cyclopentyl-3-(3,3-diphenylpropyl)thiourea
CID 892266
1-cyclohexyl-3-[(1R)-1-phenylethyl]urea
CID 840473
1-(2-anilinoethyl)-3-cyclohexylurea
CID 22978773
1-[2-(4-chlorophenyl)-2-hydroxyethyl]-3-cyclohexylurea
CID 14458365

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-3-(2,2-diphenylethyl)urea?
The IUPAC name of 1-cyclopentyl-3-(2,2-diphenylethyl)urea (CID 38287341) is 1-cyclopentyl-3-(2,2-diphenylethyl)urea.
What is the SMILES notation for 1-cyclopentyl-3-(2,2-diphenylethyl)urea?
The canonical SMILES for 1-cyclopentyl-3-(2,2-diphenylethyl)urea is O=C(NCC(c1ccccc1)c1ccccc1)NC1CCCC1.
What is the InChIKey of 1-cyclopentyl-3-(2,2-diphenylethyl)urea?
The InChIKey is ZHLZPYQWJHNJBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O/c23-20(22-18-13-7-8-14-18)21-15-19(16-9-3-1-4-10-16)17-11-5-2-6-12-17/h1-6,9-12,18-19H,7-8,13-15H2,(H2,21,22,23).
What are the key properties of 1-cyclopentyl-3-(2,2-diphenylethyl)urea?
1-cyclopentyl-3-(2,2-diphenylethyl)urea has a molecular weight of 308.43 g/mol, XLogP of 4.06, 5 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-3-(2,2-diphenylethyl)urea is sourced from PubChem (CID 38287341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).