2-(4-chlorophenyl)-3-(cyclopropylmethyl)-5-ethylimidazolidin-4-one

C15H19ClN2O — CID 83251669

IUPAC2-(4-chlorophenyl)-3-(cyclopropylmethyl)-5-ethylimidazolidin-4-one
SMILESCCC1NC(c2ccc(Cl)cc2)N(CC2CC2)C1=O
InChIInChI=1S/C15H19ClN2O/c1-2-13-15(19)18(9-10-3-4-10)14(17-13)11-5-7-12(16)8-6-11/h5-8,10,13-14,17H,2-4,9H2,1H3
InChIKeyYNMQJPNLIDDPMI-UHFFFAOYSA-N
MW278.78 g/mol
LogP2.96
Rot. Bonds4

About 2-(4-chlorophenyl)-3-(cyclopropylmethyl)-5-ethylimidazolidin-4-one

2-(4-chlorophenyl)-3-(cyclopropylmethyl)-5-ethylimidazolidin-4-one (PubChem CID 83251669) has the molecular formula C15H19ClN2O and a molecular weight of 278.78 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-3-(cyclopropylmethyl)-5-ethylimidazolidin-4-one.

Molecular Properties

Compound Name2-(4-chlorophenyl)-3-(cyclopropylmethyl)-5-ethylimidazolidin-4-one
PubChem CID83251669
Molecular FormulaC15H19ClN2O
Molecular Weight278.78 g/mol
Exact Mass278.12
IUPAC Name2-(4-chlorophenyl)-3-(cyclopropylmethyl)-5-ethylimidazolidin-4-one
SMILESCCC1NC(c2ccc(Cl)cc2)N(CC2CC2)C1=O
InChIInChI=1S/C15H19ClN2O/c1-2-13-15(19)18(9-10-3-4-10)14(17-13)11-5-7-12(16)8-6-11/h5-8,10,13-14,17H,2-4,9H2,1H3
InChIKeyYNMQJPNLIDDPMI-UHFFFAOYSA-N
XLogP2.96
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.78
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-3-(cyclopropylmethyl)-5-ethylimidazolidin-4-one?
The IUPAC name of 2-(4-chlorophenyl)-3-(cyclopropylmethyl)-5-ethylimidazolidin-4-one (CID 83251669) is 2-(4-chlorophenyl)-3-(cyclopropylmethyl)-5-ethylimidazolidin-4-one.
What is the SMILES notation for 2-(4-chlorophenyl)-3-(cyclopropylmethyl)-5-ethylimidazolidin-4-one?
The canonical SMILES for 2-(4-chlorophenyl)-3-(cyclopropylmethyl)-5-ethylimidazolidin-4-one is CCC1NC(c2ccc(Cl)cc2)N(CC2CC2)C1=O.
What is the InChIKey of 2-(4-chlorophenyl)-3-(cyclopropylmethyl)-5-ethylimidazolidin-4-one?
The InChIKey is YNMQJPNLIDDPMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19ClN2O/c1-2-13-15(19)18(9-10-3-4-10)14(17-13)11-5-7-12(16)8-6-11/h5-8,10,13-14,17H,2-4,9H2,1H3.
What are the key properties of 2-(4-chlorophenyl)-3-(cyclopropylmethyl)-5-ethylimidazolidin-4-one?
2-(4-chlorophenyl)-3-(cyclopropylmethyl)-5-ethylimidazolidin-4-one has a molecular weight of 278.78 g/mol, XLogP of 2.96, 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-(cyclopropylmethyl)-5-ethylimidazolidin-4-one is sourced from PubChem (CID 83251669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).