5-butyl-3-cycloheptyl-2-propan-2-ylimidazolidin-4-one

C17H32N2O — CID 83244477

IUPAC5-butyl-3-cycloheptyl-2-propan-2-ylimidazolidin-4-one
SMILESCCCCC1NC(C(C)C)N(C2CCCCCC2)C1=O
InChIInChI=1S/C17H32N2O/c1-4-5-12-15-17(20)19(16(18-15)13(2)3)14-10-8-6-7-9-11-14/h13-16,18H,4-12H2,1-3H3
InChIKeyJEZLENYUOXAIDU-UHFFFAOYSA-N
MW280.46 g/mol
LogP3.68
Rot. Bonds5

About 5-butyl-3-cycloheptyl-2-propan-2-ylimidazolidin-4-one

5-butyl-3-cycloheptyl-2-propan-2-ylimidazolidin-4-one (PubChem CID 83244477) has the molecular formula C17H32N2O and a molecular weight of 280.46 g/mol. Its IUPAC name is 5-butyl-3-cycloheptyl-2-propan-2-ylimidazolidin-4-one.

Molecular Properties

Compound Name5-butyl-3-cycloheptyl-2-propan-2-ylimidazolidin-4-one
PubChem CID83244477
Molecular FormulaC17H32N2O
Molecular Weight280.46 g/mol
Exact Mass280.25
IUPAC Name5-butyl-3-cycloheptyl-2-propan-2-ylimidazolidin-4-one
SMILESCCCCC1NC(C(C)C)N(C2CCCCCC2)C1=O
InChIInChI=1S/C17H32N2O/c1-4-5-12-15-17(20)19(16(18-15)13(2)3)14-10-8-6-7-9-11-14/h13-16,18H,4-12H2,1-3H3
InChIKeyJEZLENYUOXAIDU-UHFFFAOYSA-N
XLogP3.68
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 ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 5-butyl-3-cycloheptyl-2-propan-2-ylimidazolidin-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

5-butyl-3-(oxan-3-yl)-2-propan-2-ylimidazolidin-4-one
CID 83262754
5-butyl-3-cyclooctyl-2-propylimidazolidin-4-one
CID 83238137
5-butyl-3-(3-ethyl-2-methylcyclopentyl)-2-propan-2-ylimidazolidin-4-one
CID 83266918
3-(1-azabicyclo[2.2.2]octan-3-yl)-5-butyl-2-propan-2-ylimidazolidin-4-one
CID 83236937
5-butyl-3-(cyclobutylmethyl)-2-propan-2-ylimidazolidin-4-one
CID 83244060
3-cyclooctyl-2-ethyl-5-propylimidazolidin-4-one
CID 83238796
5-butyl-2-methyl-3-(2-methylcycloheptyl)imidazolidin-4-one
CID 83259175
1-cycloheptyl-6-propan-2-yl-3-propylpiperazine-2,5-dione
CID 64959767
5-ethyl-3-(1-methylpiperidin-3-yl)-2-propan-2-ylimidazolidin-4-one
CID 83256390
5-butyl-3-(1-cyclopentylethyl)-2-methylimidazolidin-4-one
CID 83264217
5-butyl-3-heptan-2-yl-2-propan-2-ylimidazolidin-4-one
CID 83253856
5-butyl-2-ethyl-3-(4-methylcyclohexyl)imidazolidin-4-one
CID 83238921

Frequently Asked Questions

What is the IUPAC name of 5-butyl-3-cycloheptyl-2-propan-2-ylimidazolidin-4-one?
The IUPAC name of 5-butyl-3-cycloheptyl-2-propan-2-ylimidazolidin-4-one (CID 83244477) is 5-butyl-3-cycloheptyl-2-propan-2-ylimidazolidin-4-one.
What is the SMILES notation for 5-butyl-3-cycloheptyl-2-propan-2-ylimidazolidin-4-one?
The canonical SMILES for 5-butyl-3-cycloheptyl-2-propan-2-ylimidazolidin-4-one is CCCCC1NC(C(C)C)N(C2CCCCCC2)C1=O.
What is the InChIKey of 5-butyl-3-cycloheptyl-2-propan-2-ylimidazolidin-4-one?
The InChIKey is JEZLENYUOXAIDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N2O/c1-4-5-12-15-17(20)19(16(18-15)13(2)3)14-10-8-6-7-9-11-14/h13-16,18H,4-12H2,1-3H3.
What are the key properties of 5-butyl-3-cycloheptyl-2-propan-2-ylimidazolidin-4-one?
5-butyl-3-cycloheptyl-2-propan-2-ylimidazolidin-4-one has a molecular weight of 280.46 g/mol, XLogP of 3.68, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-butyl-3-cycloheptyl-2-propan-2-ylimidazolidin-4-one is sourced from PubChem (CID 83244477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).