3-(1-cyclopropylethyl)-5-methyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one

C14H20N2OS — CID 83244020

IUPAC3-(1-cyclopropylethyl)-5-methyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one
SMILESCc1ccc(C2NC(C)C(=O)N2C(C)C2CC2)s1
InChIInChI=1S/C14H20N2OS/c1-8-4-7-12(18-8)13-15-9(2)14(17)16(13)10(3)11-5-6-11/h4,7,9-11,13,15H,5-6H2,1-3H3
InChIKeySSALYHWXDUZSAC-UHFFFAOYSA-N
MW264.39 g/mol
LogP2.67
Rot. Bonds3

About 3-(1-cyclopropylethyl)-5-methyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one

3-(1-cyclopropylethyl)-5-methyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one (PubChem CID 83244020) has the molecular formula C14H20N2OS and a molecular weight of 264.39 g/mol. Its IUPAC name is 3-(1-cyclopropylethyl)-5-methyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one.

Molecular Properties

Compound Name3-(1-cyclopropylethyl)-5-methyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one
PubChem CID83244020
Molecular FormulaC14H20N2OS
Molecular Weight264.39 g/mol
Exact Mass264.13
IUPAC Name3-(1-cyclopropylethyl)-5-methyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one
SMILESCc1ccc(C2NC(C)C(=O)N2C(C)C2CC2)s1
InChIInChI=1S/C14H20N2OS/c1-8-4-7-12(18-8)13-15-9(2)14(17)16(13)10(3)11-5-6-11/h4,7,9-11,13,15H,5-6H2,1-3H3
InChIKeySSALYHWXDUZSAC-UHFFFAOYSA-N
XLogP2.67
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.39
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(1-cyclopropylethyl)-5-methyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one?
The IUPAC name of 3-(1-cyclopropylethyl)-5-methyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one (CID 83244020) is 3-(1-cyclopropylethyl)-5-methyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one.
What is the SMILES notation for 3-(1-cyclopropylethyl)-5-methyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one?
The canonical SMILES for 3-(1-cyclopropylethyl)-5-methyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one is Cc1ccc(C2NC(C)C(=O)N2C(C)C2CC2)s1.
What is the InChIKey of 3-(1-cyclopropylethyl)-5-methyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one?
The InChIKey is SSALYHWXDUZSAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2OS/c1-8-4-7-12(18-8)13-15-9(2)14(17)16(13)10(3)11-5-6-11/h4,7,9-11,13,15H,5-6H2,1-3H3.
What are the key properties of 3-(1-cyclopropylethyl)-5-methyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one?
3-(1-cyclopropylethyl)-5-methyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one has a molecular weight of 264.39 g/mol, XLogP of 2.67, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-cyclopropylethyl)-5-methyl-2-(5-methylthiophen-2-yl)imidazolidin-4-one is sourced from PubChem (CID 83244020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).