3-(2-methylcyclopropyl)-5-phenyl-2-propylimidazolidin-4-one

C16H22N2O — CID 83255152

IUPAC3-(2-methylcyclopropyl)-5-phenyl-2-propylimidazolidin-4-one
SMILESCCCC1NC(c2ccccc2)C(=O)N1C1CC1C
InChIInChI=1S/C16H22N2O/c1-3-7-14-17-15(12-8-5-4-6-9-12)16(19)18(14)13-10-11(13)2/h4-6,8-9,11,13-15,17H,3,7,10H2,1-2H3
InChIKeyICHPBDAUQQBVFH-UHFFFAOYSA-N
MW258.36 g/mol
LogP2.69
Rot. Bonds4

About 3-(2-methylcyclopropyl)-5-phenyl-2-propylimidazolidin-4-one

3-(2-methylcyclopropyl)-5-phenyl-2-propylimidazolidin-4-one (PubChem CID 83255152) has the molecular formula C16H22N2O and a molecular weight of 258.36 g/mol. Its IUPAC name is 3-(2-methylcyclopropyl)-5-phenyl-2-propylimidazolidin-4-one.

Molecular Properties

Compound Name3-(2-methylcyclopropyl)-5-phenyl-2-propylimidazolidin-4-one
PubChem CID83255152
Molecular FormulaC16H22N2O
Molecular Weight258.36 g/mol
Exact Mass258.17
IUPAC Name3-(2-methylcyclopropyl)-5-phenyl-2-propylimidazolidin-4-one
SMILESCCCC1NC(c2ccccc2)C(=O)N1C1CC1C
InChIInChI=1S/C16H22N2O/c1-3-7-14-17-15(12-8-5-4-6-9-12)16(19)18(14)13-10-11(13)2/h4-6,8-9,11,13-15,17H,3,7,10H2,1-2H3
InChIKeyICHPBDAUQQBVFH-UHFFFAOYSA-N
XLogP2.69
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.36
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-cyclopentyl-5-phenyl-2-propylimidazolidin-4-one
CID 83242914
3-(3-methylbutan-2-yl)-5-phenyl-2-propylimidazolidin-4-one
CID 83250844
2-ethyl-3-(2-methyloxolan-3-yl)-5-phenylimidazolidin-4-one
CID 83260745
3-(2-methoxy-2-methylpropyl)-5-phenyl-2-propylimidazolidin-4-one
CID 104767743
3-(3-methylsulfanylpropyl)-5-phenyl-2-propylimidazolidin-4-one
CID 83257493
3-(2-methylcyclopropyl)-2-(3-methylphenyl)-5-propylimidazolidin-4-one
CID 83254821
6-(2-methylcyclopropyl)-5-propyl-4,6-diazaspiro[2.4]heptan-7-one
CID 83255505
2-ethyl-3-pentan-2-yl-5-phenylimidazolidin-4-one
CID 83239108
2-(2-methylpropyl)-5-phenyl-3-propylimidazolidin-4-one
CID 83243033
3-(2,4-dimethylcyclohexyl)-5-propan-2-yl-2-propylimidazolidin-4-one
CID 83264222
5-benzyl-2-methyl-3-(2-methylcyclopropyl)imidazolidin-4-one
CID 83254666
5-benzyl-3-cyclobutyl-2-propylimidazolidin-4-one
CID 83255145

Frequently Asked Questions

What is the IUPAC name of 3-(2-methylcyclopropyl)-5-phenyl-2-propylimidazolidin-4-one?
The IUPAC name of 3-(2-methylcyclopropyl)-5-phenyl-2-propylimidazolidin-4-one (CID 83255152) is 3-(2-methylcyclopropyl)-5-phenyl-2-propylimidazolidin-4-one.
What is the SMILES notation for 3-(2-methylcyclopropyl)-5-phenyl-2-propylimidazolidin-4-one?
The canonical SMILES for 3-(2-methylcyclopropyl)-5-phenyl-2-propylimidazolidin-4-one is CCCC1NC(c2ccccc2)C(=O)N1C1CC1C.
What is the InChIKey of 3-(2-methylcyclopropyl)-5-phenyl-2-propylimidazolidin-4-one?
The InChIKey is ICHPBDAUQQBVFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O/c1-3-7-14-17-15(12-8-5-4-6-9-12)16(19)18(14)13-10-11(13)2/h4-6,8-9,11,13-15,17H,3,7,10H2,1-2H3.
What are the key properties of 3-(2-methylcyclopropyl)-5-phenyl-2-propylimidazolidin-4-one?
3-(2-methylcyclopropyl)-5-phenyl-2-propylimidazolidin-4-one has a molecular weight of 258.36 g/mol, XLogP of 2.69, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methylcyclopropyl)-5-phenyl-2-propylimidazolidin-4-one is sourced from PubChem (CID 83255152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).