1-cyclopropyl-3-(4-methoxycyclohexyl)-1-propylurea

C14H26N2O2 — CID 58376434

IUPAC1-cyclopropyl-3-(4-methoxycyclohexyl)-1-propylurea
SMILESCCCN(C(=O)NC1CCC(OC)CC1)C1CC1
InChIInChI=1S/C14H26N2O2/c1-3-10-16(12-6-7-12)14(17)15-11-4-8-13(18-2)9-5-11/h11-13H,3-10H2,1-2H3,(H,15,17)
InChIKeyILBJQRMXLMTVAJ-UHFFFAOYSA-N
MW254.37 g/mol
LogP2.53
Rot. Bonds5

About 1-cyclopropyl-3-(4-methoxycyclohexyl)-1-propylurea

1-cyclopropyl-3-(4-methoxycyclohexyl)-1-propylurea (PubChem CID 58376434) has the molecular formula C14H26N2O2 and a molecular weight of 254.37 g/mol. Its IUPAC name is 1-cyclopropyl-3-(4-methoxycyclohexyl)-1-propylurea.

Molecular Properties

Compound Name1-cyclopropyl-3-(4-methoxycyclohexyl)-1-propylurea
PubChem CID58376434
Molecular FormulaC14H26N2O2
Molecular Weight254.37 g/mol
Exact Mass254.20
IUPAC Name1-cyclopropyl-3-(4-methoxycyclohexyl)-1-propylurea
SMILESCCCN(C(=O)NC1CCC(OC)CC1)C1CC1
InChIInChI=1S/C14H26N2O2/c1-3-10-16(12-6-7-12)14(17)15-11-4-8-13(18-2)9-5-11/h11-13H,3-10H2,1-2H3,(H,15,17)
InChIKeyILBJQRMXLMTVAJ-UHFFFAOYSA-N
XLogP2.53
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-cyclopropyl-3-(4-methoxycyclohexyl)-1-propylurea with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-3-(4-methoxycyclohexyl)-1-propylurea?
The IUPAC name of 1-cyclopropyl-3-(4-methoxycyclohexyl)-1-propylurea (CID 58376434) is 1-cyclopropyl-3-(4-methoxycyclohexyl)-1-propylurea.
What is the SMILES notation for 1-cyclopropyl-3-(4-methoxycyclohexyl)-1-propylurea?
The canonical SMILES for 1-cyclopropyl-3-(4-methoxycyclohexyl)-1-propylurea is CCCN(C(=O)NC1CCC(OC)CC1)C1CC1.
What is the InChIKey of 1-cyclopropyl-3-(4-methoxycyclohexyl)-1-propylurea?
The InChIKey is ILBJQRMXLMTVAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O2/c1-3-10-16(12-6-7-12)14(17)15-11-4-8-13(18-2)9-5-11/h11-13H,3-10H2,1-2H3,(H,15,17).
What are the key properties of 1-cyclopropyl-3-(4-methoxycyclohexyl)-1-propylurea?
1-cyclopropyl-3-(4-methoxycyclohexyl)-1-propylurea has a molecular weight of 254.37 g/mol, XLogP of 2.53, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-3-(4-methoxycyclohexyl)-1-propylurea is sourced from PubChem (CID 58376434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).