5-methyl-2-(3-methylphenyl)-3-[1-(oxolan-2-yl)ethyl]imidazolidin-4-one

C17H24N2O2 — CID 83244992

IUPAC5-methyl-2-(3-methylphenyl)-3-[1-(oxolan-2-yl)ethyl]imidazolidin-4-one
SMILESCc1cccc(C2NC(C)C(=O)N2C(C)C2CCCO2)c1
InChIInChI=1S/C17H24N2O2/c1-11-6-4-7-14(10-11)16-18-12(2)17(20)19(16)13(3)15-8-5-9-21-15/h4,6-7,10,12-13,15-16,18H,5,8-9H2,1-3H3
InChIKeyQWFMYNVJQLZHCG-UHFFFAOYSA-N
MW288.39 g/mol
LogP2.38
Rot. Bonds3

About 5-methyl-2-(3-methylphenyl)-3-[1-(oxolan-2-yl)ethyl]imidazolidin-4-one

5-methyl-2-(3-methylphenyl)-3-[1-(oxolan-2-yl)ethyl]imidazolidin-4-one (PubChem CID 83244992) has the molecular formula C17H24N2O2 and a molecular weight of 288.39 g/mol. Its IUPAC name is 5-methyl-2-(3-methylphenyl)-3-[1-(oxolan-2-yl)ethyl]imidazolidin-4-one.

Molecular Properties

Compound Name5-methyl-2-(3-methylphenyl)-3-[1-(oxolan-2-yl)ethyl]imidazolidin-4-one
PubChem CID83244992
Molecular FormulaC17H24N2O2
Molecular Weight288.39 g/mol
Exact Mass288.18
IUPAC Name5-methyl-2-(3-methylphenyl)-3-[1-(oxolan-2-yl)ethyl]imidazolidin-4-one
SMILESCc1cccc(C2NC(C)C(=O)N2C(C)C2CCCO2)c1
InChIInChI=1S/C17H24N2O2/c1-11-6-4-7-14(10-11)16-18-12(2)17(20)19(16)13(3)15-8-5-9-21-15/h4,6-7,10,12-13,15-16,18H,5,8-9H2,1-3H3
InChIKeyQWFMYNVJQLZHCG-UHFFFAOYSA-N
XLogP2.38
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-(3-methylphenyl)-3-[1-(oxolan-2-yl)ethyl]imidazolidin-4-one?
The IUPAC name of 5-methyl-2-(3-methylphenyl)-3-[1-(oxolan-2-yl)ethyl]imidazolidin-4-one (CID 83244992) is 5-methyl-2-(3-methylphenyl)-3-[1-(oxolan-2-yl)ethyl]imidazolidin-4-one.
What is the SMILES notation for 5-methyl-2-(3-methylphenyl)-3-[1-(oxolan-2-yl)ethyl]imidazolidin-4-one?
The canonical SMILES for 5-methyl-2-(3-methylphenyl)-3-[1-(oxolan-2-yl)ethyl]imidazolidin-4-one is Cc1cccc(C2NC(C)C(=O)N2C(C)C2CCCO2)c1.
What is the InChIKey of 5-methyl-2-(3-methylphenyl)-3-[1-(oxolan-2-yl)ethyl]imidazolidin-4-one?
The InChIKey is QWFMYNVJQLZHCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O2/c1-11-6-4-7-14(10-11)16-18-12(2)17(20)19(16)13(3)15-8-5-9-21-15/h4,6-7,10,12-13,15-16,18H,5,8-9H2,1-3H3.
What are the key properties of 5-methyl-2-(3-methylphenyl)-3-[1-(oxolan-2-yl)ethyl]imidazolidin-4-one?
5-methyl-2-(3-methylphenyl)-3-[1-(oxolan-2-yl)ethyl]imidazolidin-4-one has a molecular weight of 288.39 g/mol, XLogP of 2.38, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-(3-methylphenyl)-3-[1-(oxolan-2-yl)ethyl]imidazolidin-4-one is sourced from PubChem (CID 83244992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).