5-butyl-3-decylimidazolidin-4-one

C17H34N2O — CID 83270318

IUPAC5-butyl-3-decylimidazolidin-4-one
SMILESCCCCCCCCCCN1CNC(CCCC)C1=O
InChIInChI=1S/C17H34N2O/c1-3-5-7-8-9-10-11-12-14-19-15-18-16(17(19)20)13-6-4-2/h16,18H,3-15H2,1-2H3
InChIKeyYAVUUNHQIOAQGA-UHFFFAOYSA-N
MW282.47 g/mol
LogP4.08
Rot. Bonds12

About 5-butyl-3-decylimidazolidin-4-one

5-butyl-3-decylimidazolidin-4-one (PubChem CID 83270318) has the molecular formula C17H34N2O and a molecular weight of 282.47 g/mol. Its IUPAC name is 5-butyl-3-decylimidazolidin-4-one.

Molecular Properties

Compound Name5-butyl-3-decylimidazolidin-4-one
PubChem CID83270318
Molecular FormulaC17H34N2O
Molecular Weight282.47 g/mol
Exact Mass282.27
IUPAC Name5-butyl-3-decylimidazolidin-4-one
SMILESCCCCCCCCCCN1CNC(CCCC)C1=O
InChIInChI=1S/C17H34N2O/c1-3-5-7-8-9-10-11-12-14-19-15-18-16(17(19)20)13-6-4-2/h16,18H,3-15H2,1-2H3
InChIKeyYAVUUNHQIOAQGA-UHFFFAOYSA-N
XLogP4.08
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds12
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.47
LogP ≤ 54.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 5-butyl-3-decylimidazolidin-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-(4-methylpentyl)imidazolidin-4-one
CID 83257839
5-butyl-3-(3-methylsulfonylpropyl)imidazolidin-4-one
CID 83247648
5-butyl-3-(3,3,3-trifluoropropyl)imidazolidin-4-one
CID 83255355
3-butyl-5-ethylimidazolidin-4-one
CID 83238020
5-butyl-3-(cyclopropylmethyl)imidazolidin-4-one
CID 83251591
5-butyl-3-(cyclobutylmethyl)imidazolidin-4-one
CID 83244571
3-hexyl-5-propan-2-ylimidazolidin-4-one
CID 83263616
3-(3-ethoxypropyl)-5-propylimidazolidin-4-one
CID 83237865
3-[4-[methyl(propan-2-yl)amino]butyl]-5-propylimidazolidin-4-one
CID 83248232
3-[2-(dimethylamino)ethyl]-5-propylimidazolidin-4-one
CID 83251427
5-butyl-3-[(3-methylcyclopentyl)methyl]imidazolidin-4-one
CID 107416078
5-butyl-3-[(4-methyloxan-4-yl)methyl]imidazolidin-4-one
CID 114125414

Frequently Asked Questions

What is the IUPAC name of 5-butyl-3-decylimidazolidin-4-one?
The IUPAC name of 5-butyl-3-decylimidazolidin-4-one (CID 83270318) is 5-butyl-3-decylimidazolidin-4-one.
What is the SMILES notation for 5-butyl-3-decylimidazolidin-4-one?
The canonical SMILES for 5-butyl-3-decylimidazolidin-4-one is CCCCCCCCCCN1CNC(CCCC)C1=O.
What is the InChIKey of 5-butyl-3-decylimidazolidin-4-one?
The InChIKey is YAVUUNHQIOAQGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2O/c1-3-5-7-8-9-10-11-12-14-19-15-18-16(17(19)20)13-6-4-2/h16,18H,3-15H2,1-2H3.
What are the key properties of 5-butyl-3-decylimidazolidin-4-one?
5-butyl-3-decylimidazolidin-4-one has a molecular weight of 282.47 g/mol, XLogP of 4.08, 12 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-butyl-3-decylimidazolidin-4-one is sourced from PubChem (CID 83270318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).