3-(3-methylcyclopentyl)-2-(5-methylthiophen-2-yl)imidazolidin-4-one

C14H20N2OS — CID 114552339

IUPAC3-(3-methylcyclopentyl)-2-(5-methylthiophen-2-yl)imidazolidin-4-one
SMILESCc1ccc(C2NCC(=O)N2C2CCC(C)C2)s1
InChIInChI=1S/C14H20N2OS/c1-9-3-5-11(7-9)16-13(17)8-15-14(16)12-6-4-10(2)18-12/h4,6,9,11,14-15H,3,5,7-8H2,1-2H3
InChIKeyGKZPPTQGPYHWPU-UHFFFAOYSA-N
MW264.39 g/mol
LogP2.68
Rot. Bonds2

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

3-(3-methylcyclopentyl)-2-(5-methylthiophen-2-yl)imidazolidin-4-one (PubChem CID 114552339) has the molecular formula C14H20N2OS and a molecular weight of 264.39 g/mol. Its IUPAC name is 3-(3-methylcyclopentyl)-2-(5-methylthiophen-2-yl)imidazolidin-4-one.

Molecular Properties

Compound Name3-(3-methylcyclopentyl)-2-(5-methylthiophen-2-yl)imidazolidin-4-one
PubChem CID114552339
Molecular FormulaC14H20N2OS
Molecular Weight264.39 g/mol
Exact Mass264.13
IUPAC Name3-(3-methylcyclopentyl)-2-(5-methylthiophen-2-yl)imidazolidin-4-one
SMILESCc1ccc(C2NCC(=O)N2C2CCC(C)C2)s1
InChIInChI=1S/C14H20N2OS/c1-9-3-5-11(7-9)16-13(17)8-15-14(16)12-6-4-10(2)18-12/h4,6,9,11,14-15H,3,5,7-8H2,1-2H3
InChIKeyGKZPPTQGPYHWPU-UHFFFAOYSA-N
XLogP2.68
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.39
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(3-methylcyclopentyl)-2-(5-methylthiophen-2-yl)imidazolidin-4-one?
The IUPAC name of 3-(3-methylcyclopentyl)-2-(5-methylthiophen-2-yl)imidazolidin-4-one (CID 114552339) is 3-(3-methylcyclopentyl)-2-(5-methylthiophen-2-yl)imidazolidin-4-one.
What is the SMILES notation for 3-(3-methylcyclopentyl)-2-(5-methylthiophen-2-yl)imidazolidin-4-one?
The canonical SMILES for 3-(3-methylcyclopentyl)-2-(5-methylthiophen-2-yl)imidazolidin-4-one is Cc1ccc(C2NCC(=O)N2C2CCC(C)C2)s1.
What is the InChIKey of 3-(3-methylcyclopentyl)-2-(5-methylthiophen-2-yl)imidazolidin-4-one?
The InChIKey is GKZPPTQGPYHWPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2OS/c1-9-3-5-11(7-9)16-13(17)8-15-14(16)12-6-4-10(2)18-12/h4,6,9,11,14-15H,3,5,7-8H2,1-2H3.
What are the key properties of 3-(3-methylcyclopentyl)-2-(5-methylthiophen-2-yl)imidazolidin-4-one?
3-(3-methylcyclopentyl)-2-(5-methylthiophen-2-yl)imidazolidin-4-one has a molecular weight of 264.39 g/mol, XLogP of 2.68, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-methylcyclopentyl)-2-(5-methylthiophen-2-yl)imidazolidin-4-one is sourced from PubChem (CID 114552339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).