(2-cyclopentylphenyl)urea

C12H16N2O — CID 154512225

IUPAC(2-cyclopentylphenyl)urea
SMILESNC(=O)Nc1ccccc1C1CCCC1
InChIInChI=1S/C12H16N2O/c13-12(15)14-11-8-4-3-7-10(11)9-5-1-2-6-9/h3-4,7-9H,1-2,5-6H2,(H3,13,14,15)
InChIKeyLBLXHDSPNHZDME-UHFFFAOYSA-N
MW204.27 g/mol
LogP2.83
Rot. Bonds2

About (2-cyclopentylphenyl)urea

(2-cyclopentylphenyl)urea (PubChem CID 154512225) has the molecular formula C12H16N2O and a molecular weight of 204.27 g/mol. Its IUPAC name is (2-cyclopentylphenyl)urea.

Molecular Properties

Compound Name(2-cyclopentylphenyl)urea
PubChem CID154512225
Molecular FormulaC12H16N2O
Molecular Weight204.27 g/mol
Exact Mass204.13
IUPAC Name(2-cyclopentylphenyl)urea
SMILESNC(=O)Nc1ccccc1C1CCCC1
InChIInChI=1S/C12H16N2O/c13-12(15)14-11-8-4-3-7-10(11)9-5-1-2-6-9/h3-4,7-9H,1-2,5-6H2,(H3,13,14,15)
InChIKeyLBLXHDSPNHZDME-UHFFFAOYSA-N
XLogP2.83
TPSA55.12 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 ≤ 52.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (2-cyclopentylphenyl)urea?
The IUPAC name of (2-cyclopentylphenyl)urea (CID 154512225) is (2-cyclopentylphenyl)urea.
What is the SMILES notation for (2-cyclopentylphenyl)urea?
The canonical SMILES for (2-cyclopentylphenyl)urea is NC(=O)Nc1ccccc1C1CCCC1.
What is the InChIKey of (2-cyclopentylphenyl)urea?
The InChIKey is LBLXHDSPNHZDME-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O/c13-12(15)14-11-8-4-3-7-10(11)9-5-1-2-6-9/h3-4,7-9H,1-2,5-6H2,(H3,13,14,15).
What are the key properties of (2-cyclopentylphenyl)urea?
(2-cyclopentylphenyl)urea has a molecular weight of 204.27 g/mol, XLogP of 2.83, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-cyclopentylphenyl)urea is sourced from PubChem (CID 154512225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).