1-(cyclopenten-1-yl)-2-(4-methyl-1,3-thiazol-2-yl)ethanone

C11H13NOS — CID 103448185

IUPAC1-(cyclopenten-1-yl)-2-(4-methyl-1,3-thiazol-2-yl)ethanone
SMILESCc1csc(CC(=O)C2=CCCC2)n1
InChIInChI=1S/C11H13NOS/c1-8-7-14-11(12-8)6-10(13)9-4-2-3-5-9/h4,7H,2-3,5-6H2,1H3
InChIKeySYZYALBNGWVVMZ-UHFFFAOYSA-N
MW207.30 g/mol
LogP2.67
Rot. Bonds3

About 1-(cyclopenten-1-yl)-2-(4-methyl-1,3-thiazol-2-yl)ethanone

1-(cyclopenten-1-yl)-2-(4-methyl-1,3-thiazol-2-yl)ethanone (PubChem CID 103448185) has the molecular formula C11H13NOS and a molecular weight of 207.30 g/mol. Its IUPAC name is 1-(cyclopenten-1-yl)-2-(4-methyl-1,3-thiazol-2-yl)ethanone.

Molecular Properties

Compound Name1-(cyclopenten-1-yl)-2-(4-methyl-1,3-thiazol-2-yl)ethanone
PubChem CID103448185
Molecular FormulaC11H13NOS
Molecular Weight207.30 g/mol
Exact Mass207.07
IUPAC Name1-(cyclopenten-1-yl)-2-(4-methyl-1,3-thiazol-2-yl)ethanone
SMILESCc1csc(CC(=O)C2=CCCC2)n1
InChIInChI=1S/C11H13NOS/c1-8-7-14-11(12-8)6-10(13)9-4-2-3-5-9/h4,7H,2-3,5-6H2,1H3
InChIKeySYZYALBNGWVVMZ-UHFFFAOYSA-N
XLogP2.67
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.30
LogP ≤ 52.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(cyclopenten-1-yl)-2-(4-methyl-1,3-thiazol-2-yl)ethanone?
The IUPAC name of 1-(cyclopenten-1-yl)-2-(4-methyl-1,3-thiazol-2-yl)ethanone (CID 103448185) is 1-(cyclopenten-1-yl)-2-(4-methyl-1,3-thiazol-2-yl)ethanone.
What is the SMILES notation for 1-(cyclopenten-1-yl)-2-(4-methyl-1,3-thiazol-2-yl)ethanone?
The canonical SMILES for 1-(cyclopenten-1-yl)-2-(4-methyl-1,3-thiazol-2-yl)ethanone is Cc1csc(CC(=O)C2=CCCC2)n1.
What is the InChIKey of 1-(cyclopenten-1-yl)-2-(4-methyl-1,3-thiazol-2-yl)ethanone?
The InChIKey is SYZYALBNGWVVMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NOS/c1-8-7-14-11(12-8)6-10(13)9-4-2-3-5-9/h4,7H,2-3,5-6H2,1H3.
What are the key properties of 1-(cyclopenten-1-yl)-2-(4-methyl-1,3-thiazol-2-yl)ethanone?
1-(cyclopenten-1-yl)-2-(4-methyl-1,3-thiazol-2-yl)ethanone has a molecular weight of 207.30 g/mol, XLogP of 2.67, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopenten-1-yl)-2-(4-methyl-1,3-thiazol-2-yl)ethanone is sourced from PubChem (CID 103448185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).