3-cycloheptyl-5-methyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one

C16H24N2OS — CID 83243481

IUPAC3-cycloheptyl-5-methyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one
SMILESCc1ccc(C2NC(C)C(=O)N2C2CCCCCC2)s1
InChIInChI=1S/C16H24N2OS/c1-11-9-10-14(20-11)15-17-12(2)16(19)18(15)13-7-5-3-4-6-8-13/h9-10,12-13,15,17H,3-8H2,1-2H3
InChIKeyGZDNYOFTACLEJJ-UHFFFAOYSA-N
MW292.45 g/mol
LogP3.60
Rot. Bonds2

About 3-cycloheptyl-5-methyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one

3-cycloheptyl-5-methyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one (PubChem CID 83243481) has the molecular formula C16H24N2OS and a molecular weight of 292.45 g/mol. Its IUPAC name is 3-cycloheptyl-5-methyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one.

Molecular Properties

Compound Name3-cycloheptyl-5-methyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one
PubChem CID83243481
Molecular FormulaC16H24N2OS
Molecular Weight292.45 g/mol
Exact Mass292.16
IUPAC Name3-cycloheptyl-5-methyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one
SMILESCc1ccc(C2NC(C)C(=O)N2C2CCCCCC2)s1
InChIInChI=1S/C16H24N2OS/c1-11-9-10-14(20-11)15-17-12(2)16(19)18(15)13-7-5-3-4-6-8-13/h9-10,12-13,15,17H,3-8H2,1-2H3
InChIKeyGZDNYOFTACLEJJ-UHFFFAOYSA-N
XLogP3.60
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.45
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-methyl-3-(1-methylpiperidin-4-yl)-2-(5-methylthiophen-2-yl)imidazolidin-4-one
CID 83244068
3-cyclopentyl-5-methyl-2-thiophen-2-ylimidazolidin-4-one
CID 83243098
3-cyclopentyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one
CID 83243272
3-cyclopentyl-5-methyl-2-(4-methylphenyl)imidazolidin-4-one
CID 83243189
3-cyclopentyl-5-ethyl-5-methyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one
CID 83243192
3-cyclobutyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one
CID 83254899
3-(1-cyclopropylethyl)-5-methyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one
CID 83244020
5-butyl-3-cyclopropyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one
CID 83242881
3-cyclopentyl-2-(4-fluorophenyl)-5-methylimidazolidin-4-one
CID 83241955
5-methyl-2-(5-methylthiophen-2-yl)-3-pentan-3-ylimidazolidin-4-one
CID 83242674
2-(5-methylthiophen-2-yl)-3-(oxan-4-yl)-5-propylimidazolidin-4-one
CID 83245482
5-ethyl-2-(5-methylthiophen-2-yl)-3-(thiolan-3-yl)imidazolidin-4-one
CID 103065521

Frequently Asked Questions

What is the IUPAC name of 3-cycloheptyl-5-methyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one?
The IUPAC name of 3-cycloheptyl-5-methyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one (CID 83243481) is 3-cycloheptyl-5-methyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one.
What is the SMILES notation for 3-cycloheptyl-5-methyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one?
The canonical SMILES for 3-cycloheptyl-5-methyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one is Cc1ccc(C2NC(C)C(=O)N2C2CCCCCC2)s1.
What is the InChIKey of 3-cycloheptyl-5-methyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one?
The InChIKey is GZDNYOFTACLEJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2OS/c1-11-9-10-14(20-11)15-17-12(2)16(19)18(15)13-7-5-3-4-6-8-13/h9-10,12-13,15,17H,3-8H2,1-2H3.
What are the key properties of 3-cycloheptyl-5-methyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one?
3-cycloheptyl-5-methyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one has a molecular weight of 292.45 g/mol, XLogP of 3.60, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cycloheptyl-5-methyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one is sourced from PubChem (CID 83243481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).