2-(4-chlorophenyl)-3-(1-cyclopropylethyl)-5-ethylimidazolidin-4-one

C16H21ClN2O — CID 83243617

IUPAC2-(4-chlorophenyl)-3-(1-cyclopropylethyl)-5-ethylimidazolidin-4-one
SMILESCCC1NC(c2ccc(Cl)cc2)N(C(C)C2CC2)C1=O
InChIInChI=1S/C16H21ClN2O/c1-3-14-16(20)19(10(2)11-4-5-11)15(18-14)12-6-8-13(17)9-7-12/h6-11,14-15,18H,3-5H2,1-2H3
InChIKeyWRXMXBJUHVGXBA-UHFFFAOYSA-N
MW292.81 g/mol
LogP3.35
Rot. Bonds4

About 2-(4-chlorophenyl)-3-(1-cyclopropylethyl)-5-ethylimidazolidin-4-one

2-(4-chlorophenyl)-3-(1-cyclopropylethyl)-5-ethylimidazolidin-4-one (PubChem CID 83243617) has the molecular formula C16H21ClN2O and a molecular weight of 292.81 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-3-(1-cyclopropylethyl)-5-ethylimidazolidin-4-one.

Molecular Properties

Compound Name2-(4-chlorophenyl)-3-(1-cyclopropylethyl)-5-ethylimidazolidin-4-one
PubChem CID83243617
Molecular FormulaC16H21ClN2O
Molecular Weight292.81 g/mol
Exact Mass292.13
IUPAC Name2-(4-chlorophenyl)-3-(1-cyclopropylethyl)-5-ethylimidazolidin-4-one
SMILESCCC1NC(c2ccc(Cl)cc2)N(C(C)C2CC2)C1=O
InChIInChI=1S/C16H21ClN2O/c1-3-14-16(20)19(10(2)11-4-5-11)15(18-14)12-6-8-13(17)9-7-12/h6-11,14-15,18H,3-5H2,1-2H3
InChIKeyWRXMXBJUHVGXBA-UHFFFAOYSA-N
XLogP3.35
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.81
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(1-cyclopropylethyl)-5-ethyl-2-(4-methoxyphenyl)imidazolidin-4-one
CID 83248578
2-(4-chlorophenyl)-3-(1-ethoxypropan-2-yl)-5-ethylimidazolidin-4-one
CID 83245870
2-(4-chlorophenyl)-3-(cyclopropylmethyl)-5-ethylimidazolidin-4-one
CID 83251669
2-(4-chlorophenyl)-3-(1-cyclopropylethyl)imidazolidin-4-one
CID 83244273
5-(4-chlorophenyl)-6-(1-cyclopropylethyl)-4,6-diazaspiro[2.4]heptan-7-one
CID 83244732
2-(4-chlorophenyl)-5-ethyl-3-(3-methoxy-2-methylpropyl)imidazolidin-4-one
CID 83252770
2-(4-chlorophenyl)-3-(3-ethoxypropyl)-5-ethylimidazolidin-4-one
CID 83233410
3-butan-2-yl-2-(4-chlorophenyl)-5-methylimidazolidin-4-one
CID 83239935
3-butan-2-yl-5-ethyl-2-(4-methylsulfanylphenyl)imidazolidin-4-one
CID 83238950
2-(4-chlorophenyl)-5-ethyl-3-(thiolan-2-ylmethyl)imidazolidin-4-one
CID 83269990
2-(3-chlorophenyl)-5-ethyl-3-(3-methylpentan-2-yl)imidazolidin-4-one
CID 83247620
3-(1-cyclopropylethyl)-2-(2-methylphenyl)-5-propylimidazolidin-4-one
CID 83244761

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-3-(1-cyclopropylethyl)-5-ethylimidazolidin-4-one?
The IUPAC name of 2-(4-chlorophenyl)-3-(1-cyclopropylethyl)-5-ethylimidazolidin-4-one (CID 83243617) is 2-(4-chlorophenyl)-3-(1-cyclopropylethyl)-5-ethylimidazolidin-4-one.
What is the SMILES notation for 2-(4-chlorophenyl)-3-(1-cyclopropylethyl)-5-ethylimidazolidin-4-one?
The canonical SMILES for 2-(4-chlorophenyl)-3-(1-cyclopropylethyl)-5-ethylimidazolidin-4-one is CCC1NC(c2ccc(Cl)cc2)N(C(C)C2CC2)C1=O.
What is the InChIKey of 2-(4-chlorophenyl)-3-(1-cyclopropylethyl)-5-ethylimidazolidin-4-one?
The InChIKey is WRXMXBJUHVGXBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21ClN2O/c1-3-14-16(20)19(10(2)11-4-5-11)15(18-14)12-6-8-13(17)9-7-12/h6-11,14-15,18H,3-5H2,1-2H3.
What are the key properties of 2-(4-chlorophenyl)-3-(1-cyclopropylethyl)-5-ethylimidazolidin-4-one?
2-(4-chlorophenyl)-3-(1-cyclopropylethyl)-5-ethylimidazolidin-4-one has a molecular weight of 292.81 g/mol, XLogP of 3.35, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-3-(1-cyclopropylethyl)-5-ethylimidazolidin-4-one is sourced from PubChem (CID 83243617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).