3-(1-cyclopropylethyl)-2-(4-methoxy-3-methylphenyl)imidazolidin-4-one

C16H22N2O2 — CID 83244192

IUPAC3-(1-cyclopropylethyl)-2-(4-methoxy-3-methylphenyl)imidazolidin-4-one
SMILESCOc1ccc(C2NCC(=O)N2C(C)C2CC2)cc1C
InChIInChI=1S/C16H22N2O2/c1-10-8-13(6-7-14(10)20-3)16-17-9-15(19)18(16)11(2)12-4-5-12/h6-8,11-12,16-17H,4-5,9H2,1-3H3
InChIKeyKTQJKNHKFCOJKM-UHFFFAOYSA-N
MW274.36 g/mol
LogP2.23
Rot. Bonds4

About 3-(1-cyclopropylethyl)-2-(4-methoxy-3-methylphenyl)imidazolidin-4-one

3-(1-cyclopropylethyl)-2-(4-methoxy-3-methylphenyl)imidazolidin-4-one (PubChem CID 83244192) has the molecular formula C16H22N2O2 and a molecular weight of 274.36 g/mol. Its IUPAC name is 3-(1-cyclopropylethyl)-2-(4-methoxy-3-methylphenyl)imidazolidin-4-one.

Molecular Properties

Compound Name3-(1-cyclopropylethyl)-2-(4-methoxy-3-methylphenyl)imidazolidin-4-one
PubChem CID83244192
Molecular FormulaC16H22N2O2
Molecular Weight274.36 g/mol
Exact Mass274.17
IUPAC Name3-(1-cyclopropylethyl)-2-(4-methoxy-3-methylphenyl)imidazolidin-4-one
SMILESCOc1ccc(C2NCC(=O)N2C(C)C2CC2)cc1C
InChIInChI=1S/C16H22N2O2/c1-10-8-13(6-7-14(10)20-3)16-17-9-15(19)18(16)11(2)12-4-5-12/h6-8,11-12,16-17H,4-5,9H2,1-3H3
InChIKeyKTQJKNHKFCOJKM-UHFFFAOYSA-N
XLogP2.23
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.36
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-chlorophenyl)-3-(1-cyclopropylethyl)imidazolidin-4-one
CID 83244273
2-(4-methoxy-3-methylphenyl)-3-(2-methylbutyl)imidazolidin-4-one
CID 83253955
2-(4-methoxy-3-methylphenyl)-3-(oxolan-3-yl)imidazolidin-4-one
CID 83270371
2-(3-fluoro-4-methoxyphenyl)-3-pentan-3-ylimidazolidin-4-one
CID 83242836
3-(1-cyclopropylethyl)-2-(3-fluoro-4-methoxyphenyl)-5-methylimidazolidin-4-one
CID 83248555
(2R)-2-(4-methoxy-3-methylphenyl)azetidine
CID 130665442
2-(3-fluoro-4-methoxyphenyl)-3-(2-propan-2-yloxyethyl)imidazolidin-4-one
CID 114983330
6-cyclopropyl-5-(4-methoxy-3-methylphenyl)-4,6-diazaspiro[2.4]heptan-7-one
CID 83245154
2-(4-chlorophenyl)-3-(dicyclopropylmethyl)imidazolidin-4-one
CID 83253193
6-cyclobutyl-5-(4-methoxy-3-methylphenyl)-4,6-diazaspiro[2.4]heptan-7-one
CID 83250316
2-(3-chlorophenyl)-3-(dicyclopropylmethyl)imidazolidin-4-one
CID 83253191
3-[4-(dimethylamino)butan-2-yl]-2-(3-methoxyphenyl)imidazolidin-4-one
CID 83253333

Frequently Asked Questions

What is the IUPAC name of 3-(1-cyclopropylethyl)-2-(4-methoxy-3-methylphenyl)imidazolidin-4-one?
The IUPAC name of 3-(1-cyclopropylethyl)-2-(4-methoxy-3-methylphenyl)imidazolidin-4-one (CID 83244192) is 3-(1-cyclopropylethyl)-2-(4-methoxy-3-methylphenyl)imidazolidin-4-one.
What is the SMILES notation for 3-(1-cyclopropylethyl)-2-(4-methoxy-3-methylphenyl)imidazolidin-4-one?
The canonical SMILES for 3-(1-cyclopropylethyl)-2-(4-methoxy-3-methylphenyl)imidazolidin-4-one is COc1ccc(C2NCC(=O)N2C(C)C2CC2)cc1C.
What is the InChIKey of 3-(1-cyclopropylethyl)-2-(4-methoxy-3-methylphenyl)imidazolidin-4-one?
The InChIKey is KTQJKNHKFCOJKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O2/c1-10-8-13(6-7-14(10)20-3)16-17-9-15(19)18(16)11(2)12-4-5-12/h6-8,11-12,16-17H,4-5,9H2,1-3H3.
What are the key properties of 3-(1-cyclopropylethyl)-2-(4-methoxy-3-methylphenyl)imidazolidin-4-one?
3-(1-cyclopropylethyl)-2-(4-methoxy-3-methylphenyl)imidazolidin-4-one has a molecular weight of 274.36 g/mol, XLogP of 2.23, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-cyclopropylethyl)-2-(4-methoxy-3-methylphenyl)imidazolidin-4-one is sourced from PubChem (CID 83244192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).