3-cyclohexyl-2-phenyl-5-propan-2-ylimidazolidin-4-one

C18H26N2O — CID 83246962

IUPAC3-cyclohexyl-2-phenyl-5-propan-2-ylimidazolidin-4-one
SMILESCC(C)C1NC(c2ccccc2)N(C2CCCCC2)C1=O
InChIInChI=1S/C18H26N2O/c1-13(2)16-18(21)20(15-11-7-4-8-12-15)17(19-16)14-9-5-3-6-10-14/h3,5-6,9-10,13,15-17,19H,4,7-8,11-12H2,1-2H3
InChIKeyFKRQZBJWPFGHNS-UHFFFAOYSA-N
MW286.42 g/mol
LogP3.47
Rot. Bonds3

About 3-cyclohexyl-2-phenyl-5-propan-2-ylimidazolidin-4-one

3-cyclohexyl-2-phenyl-5-propan-2-ylimidazolidin-4-one (PubChem CID 83246962) has the molecular formula C18H26N2O and a molecular weight of 286.42 g/mol. Its IUPAC name is 3-cyclohexyl-2-phenyl-5-propan-2-ylimidazolidin-4-one.

Molecular Properties

Compound Name3-cyclohexyl-2-phenyl-5-propan-2-ylimidazolidin-4-one
PubChem CID83246962
Molecular FormulaC18H26N2O
Molecular Weight286.42 g/mol
Exact Mass286.20
IUPAC Name3-cyclohexyl-2-phenyl-5-propan-2-ylimidazolidin-4-one
SMILESCC(C)C1NC(c2ccccc2)N(C2CCCCC2)C1=O
InChIInChI=1S/C18H26N2O/c1-13(2)16-18(21)20(15-11-7-4-8-12-15)17(19-16)14-9-5-3-6-10-14/h3,5-6,9-10,13,15-17,19H,4,7-8,11-12H2,1-2H3
InChIKeyFKRQZBJWPFGHNS-UHFFFAOYSA-N
XLogP3.47
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.42
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-cyclohexyl-2-phenyl-5-propan-2-ylimidazolidin-4-one?
The IUPAC name of 3-cyclohexyl-2-phenyl-5-propan-2-ylimidazolidin-4-one (CID 83246962) is 3-cyclohexyl-2-phenyl-5-propan-2-ylimidazolidin-4-one.
What is the SMILES notation for 3-cyclohexyl-2-phenyl-5-propan-2-ylimidazolidin-4-one?
The canonical SMILES for 3-cyclohexyl-2-phenyl-5-propan-2-ylimidazolidin-4-one is CC(C)C1NC(c2ccccc2)N(C2CCCCC2)C1=O.
What is the InChIKey of 3-cyclohexyl-2-phenyl-5-propan-2-ylimidazolidin-4-one?
The InChIKey is FKRQZBJWPFGHNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O/c1-13(2)16-18(21)20(15-11-7-4-8-12-15)17(19-16)14-9-5-3-6-10-14/h3,5-6,9-10,13,15-17,19H,4,7-8,11-12H2,1-2H3.
What are the key properties of 3-cyclohexyl-2-phenyl-5-propan-2-ylimidazolidin-4-one?
3-cyclohexyl-2-phenyl-5-propan-2-ylimidazolidin-4-one has a molecular weight of 286.42 g/mol, XLogP of 3.47, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexyl-2-phenyl-5-propan-2-ylimidazolidin-4-one is sourced from PubChem (CID 83246962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).