5-butyl-3-[(3-methylcyclopentyl)methyl]imidazolidin-4-one

C14H26N2O — CID 107416078

IUPAC5-butyl-3-[(3-methylcyclopentyl)methyl]imidazolidin-4-one
SMILESCCCCC1NCN(CC2CCC(C)C2)C1=O
InChIInChI=1S/C14H26N2O/c1-3-4-5-13-14(17)16(10-15-13)9-12-7-6-11(2)8-12/h11-13,15H,3-10H2,1-2H3
InChIKeyNVYWTWHDCXMXBZ-UHFFFAOYSA-N
MW238.37 g/mol
LogP2.37
Rot. Bonds5

About 5-butyl-3-[(3-methylcyclopentyl)methyl]imidazolidin-4-one

5-butyl-3-[(3-methylcyclopentyl)methyl]imidazolidin-4-one (PubChem CID 107416078) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is 5-butyl-3-[(3-methylcyclopentyl)methyl]imidazolidin-4-one.

Molecular Properties

Compound Name5-butyl-3-[(3-methylcyclopentyl)methyl]imidazolidin-4-one
PubChem CID107416078
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC Name5-butyl-3-[(3-methylcyclopentyl)methyl]imidazolidin-4-one
SMILESCCCCC1NCN(CC2CCC(C)C2)C1=O
InChIInChI=1S/C14H26N2O/c1-3-4-5-13-14(17)16(10-15-13)9-12-7-6-11(2)8-12/h11-13,15H,3-10H2,1-2H3
InChIKeyNVYWTWHDCXMXBZ-UHFFFAOYSA-N
XLogP2.37
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 5-butyl-3-[(3-methylcyclopentyl)methyl]imidazolidin-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-(cyclopropylmethyl)imidazolidin-4-one
CID 83251591
5-butyl-3-(cyclobutylmethyl)imidazolidin-4-one
CID 83244571
3-(cyclopropylmethyl)-5-ethylimidazolidin-4-one
CID 83250904
5-butyl-3-decylimidazolidin-4-one
CID 83270318
5-butyl-3-(3,3,3-trifluoropropyl)imidazolidin-4-one
CID 83255355
5-butyl-3-(4-methylpentyl)imidazolidin-4-one
CID 83257839
5-butyl-3-(3-methylsulfonylpropyl)imidazolidin-4-one
CID 83247648
3-[(2-methylcyclohexyl)methyl]-5-propylimidazolidin-4-one
CID 83256567
1-[(3-methylcyclopentyl)methyl]-3-(2-methylpropyl)piperazine-2,5-dione
CID 107415635
5-butyl-3-(cyclopropylmethyl)-2-methylimidazolidin-4-one
CID 83250992
5-butyl-3-[(4-methyloxan-4-yl)methyl]imidazolidin-4-one
CID 114125414
5-butan-2-yl-3-[(4-methylcyclohexyl)methyl]imidazolidin-4-one
CID 83254446

Frequently Asked Questions

What is the IUPAC name of 5-butyl-3-[(3-methylcyclopentyl)methyl]imidazolidin-4-one?
The IUPAC name of 5-butyl-3-[(3-methylcyclopentyl)methyl]imidazolidin-4-one (CID 107416078) is 5-butyl-3-[(3-methylcyclopentyl)methyl]imidazolidin-4-one.
What is the SMILES notation for 5-butyl-3-[(3-methylcyclopentyl)methyl]imidazolidin-4-one?
The canonical SMILES for 5-butyl-3-[(3-methylcyclopentyl)methyl]imidazolidin-4-one is CCCCC1NCN(CC2CCC(C)C2)C1=O.
What is the InChIKey of 5-butyl-3-[(3-methylcyclopentyl)methyl]imidazolidin-4-one?
The InChIKey is NVYWTWHDCXMXBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c1-3-4-5-13-14(17)16(10-15-13)9-12-7-6-11(2)8-12/h11-13,15H,3-10H2,1-2H3.
What are the key properties of 5-butyl-3-[(3-methylcyclopentyl)methyl]imidazolidin-4-one?
5-butyl-3-[(3-methylcyclopentyl)methyl]imidazolidin-4-one has a molecular weight of 238.37 g/mol, XLogP of 2.37, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-butyl-3-[(3-methylcyclopentyl)methyl]imidazolidin-4-one is sourced from PubChem (CID 107416078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).