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

C17H24N2O — CID 83254821

IUPAC3-(2-methylcyclopropyl)-2-(3-methylphenyl)-5-propylimidazolidin-4-one
SMILESCCCC1NC(c2cccc(C)c2)N(C2CC2C)C1=O
InChIInChI=1S/C17H24N2O/c1-4-6-14-17(20)19(15-10-12(15)3)16(18-14)13-8-5-7-11(2)9-13/h5,7-9,12,14-16,18H,4,6,10H2,1-3H3
InChIKeyVSQRAGOYDQUOTO-UHFFFAOYSA-N
MW272.39 g/mol
LogP3.00
Rot. Bonds4

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

3-(2-methylcyclopropyl)-2-(3-methylphenyl)-5-propylimidazolidin-4-one (PubChem CID 83254821) has the molecular formula C17H24N2O and a molecular weight of 272.39 g/mol. Its IUPAC name is 3-(2-methylcyclopropyl)-2-(3-methylphenyl)-5-propylimidazolidin-4-one.

Molecular Properties

Compound Name3-(2-methylcyclopropyl)-2-(3-methylphenyl)-5-propylimidazolidin-4-one
PubChem CID83254821
Molecular FormulaC17H24N2O
Molecular Weight272.39 g/mol
Exact Mass272.19
IUPAC Name3-(2-methylcyclopropyl)-2-(3-methylphenyl)-5-propylimidazolidin-4-one
SMILESCCCC1NC(c2cccc(C)c2)N(C2CC2C)C1=O
InChIInChI=1S/C17H24N2O/c1-4-6-14-17(20)19(15-10-12(15)3)16(18-14)13-8-5-7-11(2)9-13/h5,7-9,12,14-16,18H,4,6,10H2,1-3H3
InChIKeyVSQRAGOYDQUOTO-UHFFFAOYSA-N
XLogP3.00
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
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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Frequently Asked Questions

What is the IUPAC name of 3-(2-methylcyclopropyl)-2-(3-methylphenyl)-5-propylimidazolidin-4-one?
The IUPAC name of 3-(2-methylcyclopropyl)-2-(3-methylphenyl)-5-propylimidazolidin-4-one (CID 83254821) is 3-(2-methylcyclopropyl)-2-(3-methylphenyl)-5-propylimidazolidin-4-one.
What is the SMILES notation for 3-(2-methylcyclopropyl)-2-(3-methylphenyl)-5-propylimidazolidin-4-one?
The canonical SMILES for 3-(2-methylcyclopropyl)-2-(3-methylphenyl)-5-propylimidazolidin-4-one is CCCC1NC(c2cccc(C)c2)N(C2CC2C)C1=O.
What is the InChIKey of 3-(2-methylcyclopropyl)-2-(3-methylphenyl)-5-propylimidazolidin-4-one?
The InChIKey is VSQRAGOYDQUOTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O/c1-4-6-14-17(20)19(15-10-12(15)3)16(18-14)13-8-5-7-11(2)9-13/h5,7-9,12,14-16,18H,4,6,10H2,1-3H3.
What are the key properties of 3-(2-methylcyclopropyl)-2-(3-methylphenyl)-5-propylimidazolidin-4-one?
3-(2-methylcyclopropyl)-2-(3-methylphenyl)-5-propylimidazolidin-4-one has a molecular weight of 272.39 g/mol, XLogP of 3.00, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methylcyclopropyl)-2-(3-methylphenyl)-5-propylimidazolidin-4-one is sourced from PubChem (CID 83254821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).