3-(2,4-dimethylcyclohexyl)-5-propan-2-yl-2-propylimidazolidin-4-one

C17H32N2O — CID 83264222

IUPAC3-(2,4-dimethylcyclohexyl)-5-propan-2-yl-2-propylimidazolidin-4-one
SMILESCCCC1NC(C(C)C)C(=O)N1C1CCC(C)CC1C
InChIInChI=1S/C17H32N2O/c1-6-7-15-18-16(11(2)3)17(20)19(15)14-9-8-12(4)10-13(14)5/h11-16,18H,6-10H2,1-5H3
InChIKeySMEKRDDLSCSXFS-UHFFFAOYSA-N
MW280.46 g/mol
LogP3.39
Rot. Bonds4

About 3-(2,4-dimethylcyclohexyl)-5-propan-2-yl-2-propylimidazolidin-4-one

3-(2,4-dimethylcyclohexyl)-5-propan-2-yl-2-propylimidazolidin-4-one (PubChem CID 83264222) has the molecular formula C17H32N2O and a molecular weight of 280.46 g/mol. Its IUPAC name is 3-(2,4-dimethylcyclohexyl)-5-propan-2-yl-2-propylimidazolidin-4-one.

Molecular Properties

Compound Name3-(2,4-dimethylcyclohexyl)-5-propan-2-yl-2-propylimidazolidin-4-one
PubChem CID83264222
Molecular FormulaC17H32N2O
Molecular Weight280.46 g/mol
Exact Mass280.25
IUPAC Name3-(2,4-dimethylcyclohexyl)-5-propan-2-yl-2-propylimidazolidin-4-one
SMILESCCCC1NC(C(C)C)C(=O)N1C1CCC(C)CC1C
InChIInChI=1S/C17H32N2O/c1-6-7-15-18-16(11(2)3)17(20)19(15)14-9-8-12(4)10-13(14)5/h11-16,18H,6-10H2,1-5H3
InChIKeySMEKRDDLSCSXFS-UHFFFAOYSA-N
XLogP3.39
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.46
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-yl)-5-propan-2-yl-2-propylimidazolidin-4-one
CID 83250192
3-(oxan-4-yl)-5-propan-2-yl-2-propylimidazolidin-4-one
CID 83256757
5-propan-2-yl-2-propyl-3-(2,2,3,3-tetramethylcyclopropyl)imidazolidin-4-one
CID 83270816
3-[(4-methylcyclohexyl)methyl]-5-propan-2-yl-2-propylimidazolidin-4-one
CID 83254528
3-[(2-methylcyclohexyl)methyl]-5-propan-2-yl-2-propylimidazolidin-4-one
CID 83256565
5-butan-2-yl-3-(2-ethylcyclopropyl)-2-propylimidazolidin-4-one
CID 114109870
3-(oxan-3-yl)-5-propan-2-yl-2-propylimidazolidin-4-one
CID 83263063
3-(2,4-dimethylcyclohexyl)-5-ethyl-5-methyl-2-propylimidazolidin-4-one
CID 83263584
1-(2,4-dimethylcyclohexyl)-6-ethyl-3-propylpiperazine-2,5-dione
CID 64971821
2-methyl-3-(2-methylcyclopropyl)-5-propan-2-ylimidazolidin-4-one
CID 83255411
3-(3-methylcyclobutyl)-2-(2-methylpropyl)-5-propan-2-ylimidazolidin-4-one
CID 113467617
5-ethyl-3-(3-methylcyclopentyl)-2-propylimidazolidin-4-one
CID 114552240

Frequently Asked Questions

What is the IUPAC name of 3-(2,4-dimethylcyclohexyl)-5-propan-2-yl-2-propylimidazolidin-4-one?
The IUPAC name of 3-(2,4-dimethylcyclohexyl)-5-propan-2-yl-2-propylimidazolidin-4-one (CID 83264222) is 3-(2,4-dimethylcyclohexyl)-5-propan-2-yl-2-propylimidazolidin-4-one.
What is the SMILES notation for 3-(2,4-dimethylcyclohexyl)-5-propan-2-yl-2-propylimidazolidin-4-one?
The canonical SMILES for 3-(2,4-dimethylcyclohexyl)-5-propan-2-yl-2-propylimidazolidin-4-one is CCCC1NC(C(C)C)C(=O)N1C1CCC(C)CC1C.
What is the InChIKey of 3-(2,4-dimethylcyclohexyl)-5-propan-2-yl-2-propylimidazolidin-4-one?
The InChIKey is SMEKRDDLSCSXFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N2O/c1-6-7-15-18-16(11(2)3)17(20)19(15)14-9-8-12(4)10-13(14)5/h11-16,18H,6-10H2,1-5H3.
What are the key properties of 3-(2,4-dimethylcyclohexyl)-5-propan-2-yl-2-propylimidazolidin-4-one?
3-(2,4-dimethylcyclohexyl)-5-propan-2-yl-2-propylimidazolidin-4-one has a molecular weight of 280.46 g/mol, XLogP of 3.39, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,4-dimethylcyclohexyl)-5-propan-2-yl-2-propylimidazolidin-4-one is sourced from PubChem (CID 83264222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).