3-cyclohexyl-1-ethyl-1-phenylurea

C15H22N2O — CID 17371090

IUPAC3-cyclohexyl-1-ethyl-1-phenylurea
SMILESCCN(C(=O)NC1CCCCC1)c1ccccc1
InChIInChI=1S/C15H22N2O/c1-2-17(14-11-7-4-8-12-14)15(18)16-13-9-5-3-6-10-13/h4,7-8,11-13H,2-3,5-6,9-10H2,1H3,(H,16,18)
InChIKeyBWXGHCNBJQHNNL-UHFFFAOYSA-N
MW246.35 g/mol
LogP3.56
Rot. Bonds3

About 3-cyclohexyl-1-ethyl-1-phenylurea

3-cyclohexyl-1-ethyl-1-phenylurea (PubChem CID 17371090) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is 3-cyclohexyl-1-ethyl-1-phenylurea.

Molecular Properties

Compound Name3-cyclohexyl-1-ethyl-1-phenylurea
PubChem CID17371090
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC Name3-cyclohexyl-1-ethyl-1-phenylurea
SMILESCCN(C(=O)NC1CCCCC1)c1ccccc1
InChIInChI=1S/C15H22N2O/c1-2-17(14-11-7-4-8-12-14)15(18)16-13-9-5-3-6-10-13/h4,7-8,11-13H,2-3,5-6,9-10H2,1H3,(H,16,18)
InChIKeyBWXGHCNBJQHNNL-UHFFFAOYSA-N
XLogP3.56
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-benzyl-3-cyclohexyl-1-phenylurea
CID 602977
1-(3-aminopropyl)-3-cyclohexyl-1-phenylurea
CID 16783058
1-N-cyclopentyl-1-N'-ethyl-1-N'-phenylcyclopropane-1,1-dicarboxamide
CID 108971848
1-N-cyclohexyl-3-N-ethyl-3-N-phenylbenzene-1,3-dicarboxamide
CID 109052208
1-(4-aminophenyl)-3-cyclopropyl-1-ethylurea
CID 63233875
N-ethyl-N-phenylcyclohexanecarboxamide
CID 3884538
3-(N-acetylanilino)-N-cyclohexylpropanamide
CID 113123341
3-N-cycloheptyl-5-N-ethyl-5-N-phenylpyridine-3,5-dicarboxamide
CID 109107040
2-(N-acetylanilino)-N-cyclopentylacetamide
CID 113167073
1-(2-cyanoethyl)-3-cyclobutyl-1-phenylurea
CID 116654007
2-[[ethyl(phenyl)carbamoyl]amino]-1-methylcyclopentane-1-carboxylic acid
CID 82764290
N-[2-(cyclohexylcarbamoylamino)ethyl]-N-phenylacetamide
CID 113057217

Frequently Asked Questions

What is the IUPAC name of 3-cyclohexyl-1-ethyl-1-phenylurea?
The IUPAC name of 3-cyclohexyl-1-ethyl-1-phenylurea (CID 17371090) is 3-cyclohexyl-1-ethyl-1-phenylurea.
What is the SMILES notation for 3-cyclohexyl-1-ethyl-1-phenylurea?
The canonical SMILES for 3-cyclohexyl-1-ethyl-1-phenylurea is CCN(C(=O)NC1CCCCC1)c1ccccc1.
What is the InChIKey of 3-cyclohexyl-1-ethyl-1-phenylurea?
The InChIKey is BWXGHCNBJQHNNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-2-17(14-11-7-4-8-12-14)15(18)16-13-9-5-3-6-10-13/h4,7-8,11-13H,2-3,5-6,9-10H2,1H3,(H,16,18).
What are the key properties of 3-cyclohexyl-1-ethyl-1-phenylurea?
3-cyclohexyl-1-ethyl-1-phenylurea has a molecular weight of 246.35 g/mol, XLogP of 3.56, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexyl-1-ethyl-1-phenylurea is sourced from PubChem (CID 17371090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).