1-cyclohexyl-3-(2-cyclohexylethyl)urea

C15H28N2O — CID 11139634

IUPAC1-cyclohexyl-3-(2-cyclohexylethyl)urea
SMILESO=C(NCCC1CCCCC1)NC1CCCCC1
InChIInChI=1S/C15H28N2O/c18-15(17-14-9-5-2-6-10-14)16-12-11-13-7-3-1-4-8-13/h13-14H,1-12H2,(H2,16,17,18)
InChIKeyHRSNHXOGKOIZNB-UHFFFAOYSA-N
MW252.40 g/mol
LogP3.59
Rot. Bonds4

About 1-cyclohexyl-3-(2-cyclohexylethyl)urea

1-cyclohexyl-3-(2-cyclohexylethyl)urea (PubChem CID 11139634) has the molecular formula C15H28N2O and a molecular weight of 252.40 g/mol. Its IUPAC name is 1-cyclohexyl-3-(2-cyclohexylethyl)urea.

Molecular Properties

Compound Name1-cyclohexyl-3-(2-cyclohexylethyl)urea
PubChem CID11139634
Molecular FormulaC15H28N2O
Molecular Weight252.40 g/mol
Exact Mass252.22
IUPAC Name1-cyclohexyl-3-(2-cyclohexylethyl)urea
SMILESO=C(NCCC1CCCCC1)NC1CCCCC1
InChIInChI=1S/C15H28N2O/c18-15(17-14-9-5-2-6-10-14)16-12-11-13-7-3-1-4-8-13/h13-14H,1-12H2,(H2,16,17,18)
InChIKeyHRSNHXOGKOIZNB-UHFFFAOYSA-N
XLogP3.59
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.40
LogP ≤ 53.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

N,N'-Dicyclohexylurea
CID 4277
N-Cyclohexyl-N'-(cyclohexylmethyl)urea
CID 4153324
1-(2-Adamantyl)-3-isopropyl-urea
CID 2133297
1,3-Bis(cyclohexylmethyl)urea
CID 231515
(Cyclohexylmethyl)urea
CID 231498
1-(2-Adamantyl)-3-propyl-urea
CID 3776055
N-Cyclohexyl-N'-(2-methylcyclohexyl)urea
CID 4614451
1-(4-Tert-butylcyclohexyl)-3-cyclohexylurea
CID 11000464
1-Cyclohexyl-3-(4-methylcyclohexyl)urea
CID 11806711
N-Cyclohexyl-N'-(3-propylhexan-2-yl)carbamimidic acid
CID 3040316
1-(2-Cyclohexylethyl)-3-(3-cyclohexylpropyl)urea
CID 137631914
Urea, 1-(2-chloroethyl)-3-(4-cyclohexylmethyl-1-cyclohexyl)-
CID 216698

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-3-(2-cyclohexylethyl)urea?
The IUPAC name of 1-cyclohexyl-3-(2-cyclohexylethyl)urea (CID 11139634) is 1-cyclohexyl-3-(2-cyclohexylethyl)urea.
What is the SMILES notation for 1-cyclohexyl-3-(2-cyclohexylethyl)urea?
The canonical SMILES for 1-cyclohexyl-3-(2-cyclohexylethyl)urea is O=C(NCCC1CCCCC1)NC1CCCCC1.
What is the InChIKey of 1-cyclohexyl-3-(2-cyclohexylethyl)urea?
The InChIKey is HRSNHXOGKOIZNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O/c18-15(17-14-9-5-2-6-10-14)16-12-11-13-7-3-1-4-8-13/h13-14H,1-12H2,(H2,16,17,18).
What are the key properties of 1-cyclohexyl-3-(2-cyclohexylethyl)urea?
1-cyclohexyl-3-(2-cyclohexylethyl)urea has a molecular weight of 252.40 g/mol, XLogP of 3.59, 4 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-3-(2-cyclohexylethyl)urea is sourced from PubChem (CID 11139634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).