5-butan-2-yl-2-(4-chlorophenyl)-3-cyclopropylimidazolidin-4-one

C16H21ClN2O — CID 83242460

IUPAC5-butan-2-yl-2-(4-chlorophenyl)-3-cyclopropylimidazolidin-4-one
SMILESCCC(C)C1NC(c2ccc(Cl)cc2)N(C2CC2)C1=O
InChIInChI=1S/C16H21ClN2O/c1-3-10(2)14-16(20)19(13-8-9-13)15(18-14)11-4-6-12(17)7-5-11/h4-7,10,13-15,18H,3,8-9H2,1-2H3
InChIKeyHTLHKYRLCSFSCV-UHFFFAOYSA-N
MW292.81 g/mol
LogP3.35
Rot. Bonds4

About 5-butan-2-yl-2-(4-chlorophenyl)-3-cyclopropylimidazolidin-4-one

5-butan-2-yl-2-(4-chlorophenyl)-3-cyclopropylimidazolidin-4-one (PubChem CID 83242460) has the molecular formula C16H21ClN2O and a molecular weight of 292.81 g/mol. Its IUPAC name is 5-butan-2-yl-2-(4-chlorophenyl)-3-cyclopropylimidazolidin-4-one.

Molecular Properties

Compound Name5-butan-2-yl-2-(4-chlorophenyl)-3-cyclopropylimidazolidin-4-one
PubChem CID83242460
Molecular FormulaC16H21ClN2O
Molecular Weight292.81 g/mol
Exact Mass292.13
IUPAC Name5-butan-2-yl-2-(4-chlorophenyl)-3-cyclopropylimidazolidin-4-one
SMILESCCC(C)C1NC(c2ccc(Cl)cc2)N(C2CC2)C1=O
InChIInChI=1S/C16H21ClN2O/c1-3-10(2)14-16(20)19(13-8-9-13)15(18-14)11-4-6-12(17)7-5-11/h4-7,10,13-15,18H,3,8-9H2,1-2H3
InChIKeyHTLHKYRLCSFSCV-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

5-butan-2-yl-2-(4-chlorophenyl)-3-propylimidazolidin-4-one
CID 83242766
5-butan-2-yl-3-cyclobutyl-2-thiophen-3-ylimidazolidin-4-one
CID 83255478
5-butan-2-yl-2-(4-chlorophenyl)-3-(2-methoxyethyl)imidazolidin-4-one
CID 83246998
2-(4-chlorophenyl)-3-cyclobutyl-5-methylimidazolidin-4-one
CID 83254897
5-butan-2-yl-3-(2,2-dimethylcyclopropyl)-2-phenylimidazolidin-4-one
CID 83245806
2-(4-chlorophenyl)-5-methyl-3-(oxan-4-yl)imidazolidin-4-one
CID 83256838
2-(3-chlorophenyl)-3-cyclopentyl-5-propan-2-ylimidazolidin-4-one
CID 83245897
5-butan-2-yl-3-(1,1-dioxothian-4-yl)-2-propan-2-ylimidazolidin-4-one
CID 83245017
5-butan-2-yl-3-(1,1-dioxothian-4-yl)-2-ethylimidazolidin-4-one
CID 83244291
3-cyclohexyl-2-phenyl-5-propan-2-ylimidazolidin-4-one
CID 83246962
3-cyclopropyl-2-(3-fluoro-4-methoxyphenyl)-5-propan-2-ylimidazolidin-4-one
CID 83244666
2-(4-chlorophenyl)-3-(cyclobutylmethyl)-5-propan-2-ylimidazolidin-4-one
CID 83247048

Frequently Asked Questions

What is the IUPAC name of 5-butan-2-yl-2-(4-chlorophenyl)-3-cyclopropylimidazolidin-4-one?
The IUPAC name of 5-butan-2-yl-2-(4-chlorophenyl)-3-cyclopropylimidazolidin-4-one (CID 83242460) is 5-butan-2-yl-2-(4-chlorophenyl)-3-cyclopropylimidazolidin-4-one.
What is the SMILES notation for 5-butan-2-yl-2-(4-chlorophenyl)-3-cyclopropylimidazolidin-4-one?
The canonical SMILES for 5-butan-2-yl-2-(4-chlorophenyl)-3-cyclopropylimidazolidin-4-one is CCC(C)C1NC(c2ccc(Cl)cc2)N(C2CC2)C1=O.
What is the InChIKey of 5-butan-2-yl-2-(4-chlorophenyl)-3-cyclopropylimidazolidin-4-one?
The InChIKey is HTLHKYRLCSFSCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21ClN2O/c1-3-10(2)14-16(20)19(13-8-9-13)15(18-14)11-4-6-12(17)7-5-11/h4-7,10,13-15,18H,3,8-9H2,1-2H3.
What are the key properties of 5-butan-2-yl-2-(4-chlorophenyl)-3-cyclopropylimidazolidin-4-one?
5-butan-2-yl-2-(4-chlorophenyl)-3-cyclopropylimidazolidin-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 5-butan-2-yl-2-(4-chlorophenyl)-3-cyclopropylimidazolidin-4-one is sourced from PubChem (CID 83242460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).