5-(4-ethylthiophen-2-yl)-1H-pyridin-2-one

C11H11NOS — CID 53445780

IUPAC5-(4-ethylthiophen-2-yl)-1H-pyridin-2-one
SMILESCCc1csc(-c2ccc(=O)[nH]c2)c1
InChIInChI=1S/C11H11NOS/c1-2-8-5-10(14-7-8)9-3-4-11(13)12-6-9/h3-7H,2H2,1H3,(H,12,13)
InChIKeyPFAARRPFCKZTEU-UHFFFAOYSA-N
MW205.28 g/mol
LogP2.67
Rot. Bonds2

About 5-(4-ethylthiophen-2-yl)-1H-pyridin-2-one

5-(4-ethylthiophen-2-yl)-1H-pyridin-2-one (PubChem CID 53445780) has the molecular formula C11H11NOS and a molecular weight of 205.28 g/mol. Its IUPAC name is 5-(4-ethylthiophen-2-yl)-1H-pyridin-2-one.

Molecular Properties

Compound Name5-(4-ethylthiophen-2-yl)-1H-pyridin-2-one
PubChem CID53445780
Molecular FormulaC11H11NOS
Molecular Weight205.28 g/mol
Exact Mass205.06
IUPAC Name5-(4-ethylthiophen-2-yl)-1H-pyridin-2-one
SMILESCCc1csc(-c2ccc(=O)[nH]c2)c1
InChIInChI=1S/C11H11NOS/c1-2-8-5-10(14-7-8)9-3-4-11(13)12-6-9/h3-7H,2H2,1H3,(H,12,13)
InChIKeyPFAARRPFCKZTEU-UHFFFAOYSA-N
XLogP2.67
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.28
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-(4-ethylthiophen-2-yl)-1H-pyridin-2-one?
The IUPAC name of 5-(4-ethylthiophen-2-yl)-1H-pyridin-2-one (CID 53445780) is 5-(4-ethylthiophen-2-yl)-1H-pyridin-2-one.
What is the SMILES notation for 5-(4-ethylthiophen-2-yl)-1H-pyridin-2-one?
The canonical SMILES for 5-(4-ethylthiophen-2-yl)-1H-pyridin-2-one is CCc1csc(-c2ccc(=O)[nH]c2)c1.
What is the InChIKey of 5-(4-ethylthiophen-2-yl)-1H-pyridin-2-one?
The InChIKey is PFAARRPFCKZTEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NOS/c1-2-8-5-10(14-7-8)9-3-4-11(13)12-6-9/h3-7H,2H2,1H3,(H,12,13).
What are the key properties of 5-(4-ethylthiophen-2-yl)-1H-pyridin-2-one?
5-(4-ethylthiophen-2-yl)-1H-pyridin-2-one has a molecular weight of 205.28 g/mol, XLogP of 2.67, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-ethylthiophen-2-yl)-1H-pyridin-2-one is sourced from PubChem (CID 53445780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).