3-(2-cyclohexyl-2-oxoethyl)-1,5-dimethyl-5-(2-methylcyclopentyl)imidazolidine-2,4-dione

C19H30N2O3 — CID 90371569

IUPAC3-(2-cyclohexyl-2-oxoethyl)-1,5-dimethyl-5-(2-methylcyclopentyl)imidazolidine-2,4-dione
SMILESCC1CCCC1C1(C)C(=O)N(CC(=O)C2CCCCC2)C(=O)N1C
InChIInChI=1S/C19H30N2O3/c1-13-8-7-11-15(13)19(2)17(23)21(18(24)20(19)3)12-16(22)14-9-5-4-6-10-14/h13-15H,4-12H2,1-3H3
InChIKeyORUWTBOTWCVZCN-UHFFFAOYSA-N
MW334.46 g/mol
LogP3.22
Rot. Bonds4

About 3-(2-cyclohexyl-2-oxoethyl)-1,5-dimethyl-5-(2-methylcyclopentyl)imidazolidine-2,4-dione

3-(2-cyclohexyl-2-oxoethyl)-1,5-dimethyl-5-(2-methylcyclopentyl)imidazolidine-2,4-dione (PubChem CID 90371569) has the molecular formula C19H30N2O3 and a molecular weight of 334.46 g/mol. Its IUPAC name is 3-(2-cyclohexyl-2-oxoethyl)-1,5-dimethyl-5-(2-methylcyclopentyl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name3-(2-cyclohexyl-2-oxoethyl)-1,5-dimethyl-5-(2-methylcyclopentyl)imidazolidine-2,4-dione
PubChem CID90371569
Molecular FormulaC19H30N2O3
Molecular Weight334.46 g/mol
Exact Mass334.23
IUPAC Name3-(2-cyclohexyl-2-oxoethyl)-1,5-dimethyl-5-(2-methylcyclopentyl)imidazolidine-2,4-dione
SMILESCC1CCCC1C1(C)C(=O)N(CC(=O)C2CCCCC2)C(=O)N1C
InChIInChI=1S/C19H30N2O3/c1-13-8-7-11-15(13)19(2)17(23)21(18(24)20(19)3)12-16(22)14-9-5-4-6-10-14/h13-15H,4-12H2,1-3H3
InChIKeyORUWTBOTWCVZCN-UHFFFAOYSA-N
XLogP3.22
TPSA57.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.46
LogP ≤ 53.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-(2-cyclohexyl-2-oxoethyl)-3-methylpyrrolidine-2,5-dione
CID 104751309
5-cyclobutyl-1,5-dimethyl-3-phenacylimidazolidine-2,4-dione
CID 78324504
5-cyclohexyl-3-[2-(2-fluorophenyl)-2-oxoethyl]-1,5-dimethylimidazolidine-2,4-dione
CID 90359173
4-(2-cyclopentyl-2-oxoethyl)morpholine-3,5-dione
CID 104751314
3-[(4Z)-5-amino-3-methylidene-2-oxoocta-4,7-dienyl]-5-cyclohexyl-1,5-dimethylimidazolidine-2,4-dione
CID 138510073
2-(2-cyclopentyl-2-oxoethyl)-5-ethyl-4,5,6,6a-tetrahydro-3aH-cyclopenta[c]pyrrole-1,3-dione
CID 114513713
3-[2-(1-azaspiro[5.8]tetradecan-3-yl)-2-oxoethyl]-5-cyclopentyl-1-ethyl-5-methylimidazolidine-2,4-dione
CID 123299569
1-cyclopentyl-2-(3,4-dimethylpyrrolidin-1-yl)ethanone
CID 104750922
5-[(2S)-2-bicyclo[2.2.2]octanyl]-3-[2-(3-hydroxyphenyl)-2-oxoethyl]-1,5-dimethylimidazolidine-2,4-dione
CID 118599469
5-[(1S,4S)-2-bicyclo[2.2.1]hept-5-enyl]-1,5-dimethyl-3-[2-oxo-2-(9-tricyclo[4.2.1.12,5]deca-1,5-dienyl)ethyl]imidazolidine-2,4-dione
CID 138510093
5-[(1S,2R,4R)-2-bicyclo[2.2.1]heptanyl]-1,5-dimethyl-3-[2-(3-methylphenyl)-2-oxoethyl]imidazolidine-2,4-dione
CID 158611738
5-[(1S,2R,4R)-2-bicyclo[2.2.1]heptanyl]-3-[2-(3-hydroxyphenyl)-2-oxoethyl]-1,5-dimethylimidazolidine-2,4-dione
CID 118599544

Frequently Asked Questions

What is the IUPAC name of 3-(2-cyclohexyl-2-oxoethyl)-1,5-dimethyl-5-(2-methylcyclopentyl)imidazolidine-2,4-dione?
The IUPAC name of 3-(2-cyclohexyl-2-oxoethyl)-1,5-dimethyl-5-(2-methylcyclopentyl)imidazolidine-2,4-dione (CID 90371569) is 3-(2-cyclohexyl-2-oxoethyl)-1,5-dimethyl-5-(2-methylcyclopentyl)imidazolidine-2,4-dione.
What is the SMILES notation for 3-(2-cyclohexyl-2-oxoethyl)-1,5-dimethyl-5-(2-methylcyclopentyl)imidazolidine-2,4-dione?
The canonical SMILES for 3-(2-cyclohexyl-2-oxoethyl)-1,5-dimethyl-5-(2-methylcyclopentyl)imidazolidine-2,4-dione is CC1CCCC1C1(C)C(=O)N(CC(=O)C2CCCCC2)C(=O)N1C.
What is the InChIKey of 3-(2-cyclohexyl-2-oxoethyl)-1,5-dimethyl-5-(2-methylcyclopentyl)imidazolidine-2,4-dione?
The InChIKey is ORUWTBOTWCVZCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N2O3/c1-13-8-7-11-15(13)19(2)17(23)21(18(24)20(19)3)12-16(22)14-9-5-4-6-10-14/h13-15H,4-12H2,1-3H3.
What are the key properties of 3-(2-cyclohexyl-2-oxoethyl)-1,5-dimethyl-5-(2-methylcyclopentyl)imidazolidine-2,4-dione?
3-(2-cyclohexyl-2-oxoethyl)-1,5-dimethyl-5-(2-methylcyclopentyl)imidazolidine-2,4-dione has a molecular weight of 334.46 g/mol, XLogP of 3.22, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-cyclohexyl-2-oxoethyl)-1,5-dimethyl-5-(2-methylcyclopentyl)imidazolidine-2,4-dione is sourced from PubChem (CID 90371569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).