1-cyclopentyl-3-(2-oxoethyl)urea

C8H14N2O2 — CID 117235815

IUPAC1-cyclopentyl-3-(2-oxoethyl)urea
SMILESO=CCNC(=O)NC1CCCC1
InChIInChI=1S/C8H14N2O2/c11-6-5-9-8(12)10-7-3-1-2-4-7/h6-7H,1-5H2,(H2,9,10,12)
InChIKeyYUDFCZIXAWLXCU-UHFFFAOYSA-N
MW170.21 g/mol
LogP0.43
Rot. Bonds3

About 1-cyclopentyl-3-(2-oxoethyl)urea

1-cyclopentyl-3-(2-oxoethyl)urea (PubChem CID 117235815) has the molecular formula C8H14N2O2 and a molecular weight of 170.21 g/mol. Its IUPAC name is 1-cyclopentyl-3-(2-oxoethyl)urea.

Molecular Properties

Compound Name1-cyclopentyl-3-(2-oxoethyl)urea
PubChem CID117235815
Molecular FormulaC8H14N2O2
Molecular Weight170.21 g/mol
Exact Mass170.11
IUPAC Name1-cyclopentyl-3-(2-oxoethyl)urea
SMILESO=CCNC(=O)NC1CCCC1
InChIInChI=1S/C8H14N2O2/c11-6-5-9-8(12)10-7-3-1-2-4-7/h6-7H,1-5H2,(H2,9,10,12)
InChIKeyYUDFCZIXAWLXCU-UHFFFAOYSA-N
XLogP0.43
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.21
LogP ≤ 50.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

1-[(E)-4-chlorobut-2-enyl]-3-cyclohexylurea
CID 81428966
1-cyclohexyl-3-[2-(ethylamino)ethyl]urea
CID 62663846
1-(1,1-dioxothian-2-yl)-3-(2-oxoethyl)urea
CID 117234894
1-cyclopentyl-3-ethylurea;ethane
CID 145358709
1-cyclododecyl-3-(cyclohexylmethyl)urea
CID 108902864
1-cyclopentyl-3-propylurea
CID 14343339
N-cyclohexyl-2-(cyclopentylcarbamoylamino)acetamide
CID 84516190
1-cyclopentyl-3-[2-(2-hydroxypropylamino)ethyl]urea
CID 104593877
1-cyclobutyl-3-cyclohexylurea
CID 17217147
1-cyclopentyl-3-[(1-cyclopropylcyclopropyl)methyl]urea
CID 103839051
1-cyclohexyl-3-[2-(propan-2-ylamino)ethyl]urea
CID 62664578
1-cyclohexyl-3-[(1-methylcyclobutyl)methyl]urea
CID 103735099

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-3-(2-oxoethyl)urea?
The IUPAC name of 1-cyclopentyl-3-(2-oxoethyl)urea (CID 117235815) is 1-cyclopentyl-3-(2-oxoethyl)urea.
What is the SMILES notation for 1-cyclopentyl-3-(2-oxoethyl)urea?
The canonical SMILES for 1-cyclopentyl-3-(2-oxoethyl)urea is O=CCNC(=O)NC1CCCC1.
What is the InChIKey of 1-cyclopentyl-3-(2-oxoethyl)urea?
The InChIKey is YUDFCZIXAWLXCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O2/c11-6-5-9-8(12)10-7-3-1-2-4-7/h6-7H,1-5H2,(H2,9,10,12).
What are the key properties of 1-cyclopentyl-3-(2-oxoethyl)urea?
1-cyclopentyl-3-(2-oxoethyl)urea has a molecular weight of 170.21 g/mol, XLogP of 0.43, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-3-(2-oxoethyl)urea is sourced from PubChem (CID 117235815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).