3-(2-methylcycloheptyl)-2-thiophen-2-ylimidazolidin-4-one

C15H22N2OS — CID 83258933

IUPAC3-(2-methylcycloheptyl)-2-thiophen-2-ylimidazolidin-4-one
SMILESCC1CCCCCC1N1C(=O)CNC1c1cccs1
InChIInChI=1S/C15H22N2OS/c1-11-6-3-2-4-7-12(11)17-14(18)10-16-15(17)13-8-5-9-19-13/h5,8-9,11-12,15-16H,2-4,6-7,10H2,1H3
InChIKeyGSZJFAPXQIXUOV-UHFFFAOYSA-N
MW278.42 g/mol
LogP3.15
Rot. Bonds2

About 3-(2-methylcycloheptyl)-2-thiophen-2-ylimidazolidin-4-one

3-(2-methylcycloheptyl)-2-thiophen-2-ylimidazolidin-4-one (PubChem CID 83258933) has the molecular formula C15H22N2OS and a molecular weight of 278.42 g/mol. Its IUPAC name is 3-(2-methylcycloheptyl)-2-thiophen-2-ylimidazolidin-4-one.

Molecular Properties

Compound Name3-(2-methylcycloheptyl)-2-thiophen-2-ylimidazolidin-4-one
PubChem CID83258933
Molecular FormulaC15H22N2OS
Molecular Weight278.42 g/mol
Exact Mass278.15
IUPAC Name3-(2-methylcycloheptyl)-2-thiophen-2-ylimidazolidin-4-one
SMILESCC1CCCCCC1N1C(=O)CNC1c1cccs1
InChIInChI=1S/C15H22N2OS/c1-11-6-3-2-4-7-12(11)17-14(18)10-16-15(17)13-8-5-9-19-13/h5,8-9,11-12,15-16H,2-4,6-7,10H2,1H3
InChIKeyGSZJFAPXQIXUOV-UHFFFAOYSA-N
XLogP3.15
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.42
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(2-methylcycloheptyl)-2-(2-methylphenyl)imidazolidin-4-one
CID 83268413
3-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)-2-thiophen-2-ylimidazolidin-4-one
CID 83264573
3-(1-oxothian-4-yl)-2-thiophen-2-ylimidazolidin-4-one
CID 113480754
3-(1,1-dioxothian-4-yl)-2-thiophen-2-ylimidazolidin-4-one
CID 83244118
3-(2-methylcyclohexyl)-2-(3-methylphenyl)imidazolidin-4-one
CID 83236888
3-(3-ethylcyclohexyl)-2-thiophen-2-ylimidazolidin-4-one
CID 83258963
3-(2-cyclohexylethyl)-2-thiophen-2-ylimidazolidin-4-one
CID 83256115
2-(4-ethylphenyl)-3-(2-methylcyclohexyl)imidazolidin-4-one
CID 83237227
2-thiophen-2-yl-3-(1,3,3-trimethyl-2-bicyclo[2.2.1]heptanyl)imidazolidin-4-one
CID 83267441
3-(cyclobutylmethyl)-2-thiophen-2-ylimidazolidin-4-one
CID 83243977
3-(cyclopropylmethyl)-2-thiophen-2-ylimidazolidin-4-one
CID 83251666
3-cyclopentyl-5-methyl-2-thiophen-2-ylimidazolidin-4-one
CID 83243098

Frequently Asked Questions

What is the IUPAC name of 3-(2-methylcycloheptyl)-2-thiophen-2-ylimidazolidin-4-one?
The IUPAC name of 3-(2-methylcycloheptyl)-2-thiophen-2-ylimidazolidin-4-one (CID 83258933) is 3-(2-methylcycloheptyl)-2-thiophen-2-ylimidazolidin-4-one.
What is the SMILES notation for 3-(2-methylcycloheptyl)-2-thiophen-2-ylimidazolidin-4-one?
The canonical SMILES for 3-(2-methylcycloheptyl)-2-thiophen-2-ylimidazolidin-4-one is CC1CCCCCC1N1C(=O)CNC1c1cccs1.
What is the InChIKey of 3-(2-methylcycloheptyl)-2-thiophen-2-ylimidazolidin-4-one?
The InChIKey is GSZJFAPXQIXUOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2OS/c1-11-6-3-2-4-7-12(11)17-14(18)10-16-15(17)13-8-5-9-19-13/h5,8-9,11-12,15-16H,2-4,6-7,10H2,1H3.
What are the key properties of 3-(2-methylcycloheptyl)-2-thiophen-2-ylimidazolidin-4-one?
3-(2-methylcycloheptyl)-2-thiophen-2-ylimidazolidin-4-one has a molecular weight of 278.42 g/mol, XLogP of 3.15, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methylcycloheptyl)-2-thiophen-2-ylimidazolidin-4-one is sourced from PubChem (CID 83258933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).