3-[(4-methylcyclohexyl)methyl]-5-propan-2-yl-2-propylimidazolidin-4-one

C17H32N2O — CID 83254528

IUPAC3-[(4-methylcyclohexyl)methyl]-5-propan-2-yl-2-propylimidazolidin-4-one
SMILESCCCC1NC(C(C)C)C(=O)N1CC1CCC(C)CC1
InChIInChI=1S/C17H32N2O/c1-5-6-15-18-16(12(2)3)17(20)19(15)11-14-9-7-13(4)8-10-14/h12-16,18H,5-11H2,1-4H3
InChIKeyLEHQLWASCYUNND-UHFFFAOYSA-N
MW280.46 g/mol
LogP3.40
Rot. Bonds5

About 3-[(4-methylcyclohexyl)methyl]-5-propan-2-yl-2-propylimidazolidin-4-one

3-[(4-methylcyclohexyl)methyl]-5-propan-2-yl-2-propylimidazolidin-4-one (PubChem CID 83254528) has the molecular formula C17H32N2O and a molecular weight of 280.46 g/mol. Its IUPAC name is 3-[(4-methylcyclohexyl)methyl]-5-propan-2-yl-2-propylimidazolidin-4-one.

Molecular Properties

Compound Name3-[(4-methylcyclohexyl)methyl]-5-propan-2-yl-2-propylimidazolidin-4-one
PubChem CID83254528
Molecular FormulaC17H32N2O
Molecular Weight280.46 g/mol
Exact Mass280.25
IUPAC Name3-[(4-methylcyclohexyl)methyl]-5-propan-2-yl-2-propylimidazolidin-4-one
SMILESCCCC1NC(C(C)C)C(=O)N1CC1CCC(C)CC1
InChIInChI=1S/C17H32N2O/c1-5-6-15-18-16(12(2)3)17(20)19(15)11-14-9-7-13(4)8-10-14/h12-16,18H,5-11H2,1-4H3
InChIKeyLEHQLWASCYUNND-UHFFFAOYSA-N
XLogP3.40
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.46
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-[(4-methylcyclohexyl)methyl]-5-propan-2-yl-2-propylimidazolidin-4-one with MolForge

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

Launch Full Analysis

Related Compounds

3-[(2-methylcyclohexyl)methyl]-5-propan-2-yl-2-propylimidazolidin-4-one
CID 83256565
2-ethyl-3-[2-(4-methylcyclohexyl)ethyl]-5-propan-2-ylimidazolidin-4-one
CID 83263281
3-(cyclobutylmethyl)-2-ethyl-5-propan-2-ylimidazolidin-4-one
CID 83243656
3-(2,2-difluoroethyl)-5-propan-2-yl-2-propylimidazolidin-4-one
CID 83271211
3-(2,4-dimethylcyclohexyl)-5-propan-2-yl-2-propylimidazolidin-4-one
CID 83264222
5-butan-2-yl-3-[(2-methylcyclopropyl)methyl]-2-propylimidazolidin-4-one
CID 113464306
3-(5-methylhexyl)-5-propan-2-yl-2-propylimidazolidin-4-one
CID 83260431
5-propan-2-yl-3-(2-propan-2-yloxyethyl)-2-propylimidazolidin-4-one
CID 104767674
3-(cyclohexylmethyl)-5-(2-methylpropyl)-2-propylimidazolidin-4-one
CID 83244505
3-(7-methyloctyl)-5-propan-2-yl-2-propylimidazolidin-4-one
CID 107819269
3-[2-(oxan-2-yl)ethyl]-5-propan-2-yl-2-propylimidazolidin-4-one
CID 106000051
6-ethyl-1-[(3-methylcyclopentyl)methyl]-3-propan-2-ylpiperazine-2,5-dione
CID 107415616

Frequently Asked Questions

What is the IUPAC name of 3-[(4-methylcyclohexyl)methyl]-5-propan-2-yl-2-propylimidazolidin-4-one?
The IUPAC name of 3-[(4-methylcyclohexyl)methyl]-5-propan-2-yl-2-propylimidazolidin-4-one (CID 83254528) is 3-[(4-methylcyclohexyl)methyl]-5-propan-2-yl-2-propylimidazolidin-4-one.
What is the SMILES notation for 3-[(4-methylcyclohexyl)methyl]-5-propan-2-yl-2-propylimidazolidin-4-one?
The canonical SMILES for 3-[(4-methylcyclohexyl)methyl]-5-propan-2-yl-2-propylimidazolidin-4-one is CCCC1NC(C(C)C)C(=O)N1CC1CCC(C)CC1.
What is the InChIKey of 3-[(4-methylcyclohexyl)methyl]-5-propan-2-yl-2-propylimidazolidin-4-one?
The InChIKey is LEHQLWASCYUNND-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N2O/c1-5-6-15-18-16(12(2)3)17(20)19(15)11-14-9-7-13(4)8-10-14/h12-16,18H,5-11H2,1-4H3.
What are the key properties of 3-[(4-methylcyclohexyl)methyl]-5-propan-2-yl-2-propylimidazolidin-4-one?
3-[(4-methylcyclohexyl)methyl]-5-propan-2-yl-2-propylimidazolidin-4-one has a molecular weight of 280.46 g/mol, XLogP of 3.40, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-methylcyclohexyl)methyl]-5-propan-2-yl-2-propylimidazolidin-4-one is sourced from PubChem (CID 83254528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).