3-(cyclopentylmethyl)-5-methyl-2-(4-methylphenyl)imidazolidin-4-one

C17H24N2O — CID 83243594

IUPAC3-(cyclopentylmethyl)-5-methyl-2-(4-methylphenyl)imidazolidin-4-one
SMILESCc1ccc(C2NC(C)C(=O)N2CC2CCCC2)cc1
InChIInChI=1S/C17H24N2O/c1-12-7-9-15(10-8-12)16-18-13(2)17(20)19(16)11-14-5-3-4-6-14/h7-10,13-14,16,18H,3-6,11H2,1-2H3
InChIKeyYKQCRYYIYPDZCQ-UHFFFAOYSA-N
MW272.39 g/mol
LogP3.00
Rot. Bonds3

About 3-(cyclopentylmethyl)-5-methyl-2-(4-methylphenyl)imidazolidin-4-one

3-(cyclopentylmethyl)-5-methyl-2-(4-methylphenyl)imidazolidin-4-one (PubChem CID 83243594) has the molecular formula C17H24N2O and a molecular weight of 272.39 g/mol. Its IUPAC name is 3-(cyclopentylmethyl)-5-methyl-2-(4-methylphenyl)imidazolidin-4-one.

Molecular Properties

Compound Name3-(cyclopentylmethyl)-5-methyl-2-(4-methylphenyl)imidazolidin-4-one
PubChem CID83243594
Molecular FormulaC17H24N2O
Molecular Weight272.39 g/mol
Exact Mass272.19
IUPAC Name3-(cyclopentylmethyl)-5-methyl-2-(4-methylphenyl)imidazolidin-4-one
SMILESCc1ccc(C2NC(C)C(=O)N2CC2CCCC2)cc1
InChIInChI=1S/C17H24N2O/c1-12-7-9-15(10-8-12)16-18-13(2)17(20)19(16)11-14-5-3-4-6-14/h7-10,13-14,16,18H,3-6,11H2,1-2H3
InChIKeyYKQCRYYIYPDZCQ-UHFFFAOYSA-N
XLogP3.00
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.39
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Ethotoin
CID 3292
1-Benzylimidazolidine-2,4,5-trione
CID 562619
Acetamide, N-benzyl-2-(1-pyrrolidinyl)-, hydrochloride
CID 2959243
2,4-Imidazolidinedione, 3-(phenylmethyl)-
CID 231959
Smac peptido-mimetic 1
CID 11200722
(R)-N-Benzyl-2-(2,5-dioxopyrrolidin-1-yl)propanamide
CID 155213164
N-[1-benzyl-2,5-dioxo-4-(trifluoromethyl)imidazolidin-4-yl]pentanamide
CID 4264496
1-cyclopentyl-N-[(4-methylphenyl)methyl]-5-oxopyrrolidine-3-carboxamide
CID 16307848
3-Benzyl-2,5-dioxo-4,4-dimethylimidazolidine
CID 4601988
(4R,5S)-(-)-1,5-Dimethyl-4-phenyl-2-imidazolidinone
CID 6931391
Simufilam
CID 46195331
2-(Diethylamino)-N-(1-phenylethyl)ethanimidic acid
CID 209462

Frequently Asked Questions

What is the IUPAC name of 3-(cyclopentylmethyl)-5-methyl-2-(4-methylphenyl)imidazolidin-4-one?
The IUPAC name of 3-(cyclopentylmethyl)-5-methyl-2-(4-methylphenyl)imidazolidin-4-one (CID 83243594) is 3-(cyclopentylmethyl)-5-methyl-2-(4-methylphenyl)imidazolidin-4-one.
What is the SMILES notation for 3-(cyclopentylmethyl)-5-methyl-2-(4-methylphenyl)imidazolidin-4-one?
The canonical SMILES for 3-(cyclopentylmethyl)-5-methyl-2-(4-methylphenyl)imidazolidin-4-one is Cc1ccc(C2NC(C)C(=O)N2CC2CCCC2)cc1.
What is the InChIKey of 3-(cyclopentylmethyl)-5-methyl-2-(4-methylphenyl)imidazolidin-4-one?
The InChIKey is YKQCRYYIYPDZCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O/c1-12-7-9-15(10-8-12)16-18-13(2)17(20)19(16)11-14-5-3-4-6-14/h7-10,13-14,16,18H,3-6,11H2,1-2H3.
What are the key properties of 3-(cyclopentylmethyl)-5-methyl-2-(4-methylphenyl)imidazolidin-4-one?
3-(cyclopentylmethyl)-5-methyl-2-(4-methylphenyl)imidazolidin-4-one has a molecular weight of 272.39 g/mol, XLogP of 3.00, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclopentylmethyl)-5-methyl-2-(4-methylphenyl)imidazolidin-4-one is sourced from PubChem (CID 83243594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).