2-methyl-6-thiophen-2-yl-2,3-dihydro-1H-pyridin-4-one

C10H11NOS — CID 10420132

IUPAC2-methyl-6-thiophen-2-yl-2,3-dihydro-1H-pyridin-4-one
SMILESCC1CC(=O)C=C(c2cccs2)N1
InChIInChI=1S/C10H11NOS/c1-7-5-8(12)6-9(11-7)10-3-2-4-13-10/h2-4,6-7,11H,5H2,1H3
InChIKeyGGEIFIDWNQGZHD-UHFFFAOYSA-N
MW193.27 g/mol
LogP2.04
Rot. Bonds1

About 2-methyl-6-thiophen-2-yl-2,3-dihydro-1H-pyridin-4-one

2-methyl-6-thiophen-2-yl-2,3-dihydro-1H-pyridin-4-one (PubChem CID 10420132) has the molecular formula C10H11NOS and a molecular weight of 193.27 g/mol. Its IUPAC name is 2-methyl-6-thiophen-2-yl-2,3-dihydro-1H-pyridin-4-one.

Molecular Properties

Compound Name2-methyl-6-thiophen-2-yl-2,3-dihydro-1H-pyridin-4-one
PubChem CID10420132
Molecular FormulaC10H11NOS
Molecular Weight193.27 g/mol
Exact Mass193.06
IUPAC Name2-methyl-6-thiophen-2-yl-2,3-dihydro-1H-pyridin-4-one
SMILESCC1CC(=O)C=C(c2cccs2)N1
InChIInChI=1S/C10H11NOS/c1-7-5-8(12)6-9(11-7)10-3-2-4-13-10/h2-4,6-7,11H,5H2,1H3
InChIKeyGGEIFIDWNQGZHD-UHFFFAOYSA-N
XLogP2.04
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.27
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-thiophen-2-yl-2,3-dihydro-1H-pyridin-4-one?
The IUPAC name of 2-methyl-6-thiophen-2-yl-2,3-dihydro-1H-pyridin-4-one (CID 10420132) is 2-methyl-6-thiophen-2-yl-2,3-dihydro-1H-pyridin-4-one.
What is the SMILES notation for 2-methyl-6-thiophen-2-yl-2,3-dihydro-1H-pyridin-4-one?
The canonical SMILES for 2-methyl-6-thiophen-2-yl-2,3-dihydro-1H-pyridin-4-one is CC1CC(=O)C=C(c2cccs2)N1.
What is the InChIKey of 2-methyl-6-thiophen-2-yl-2,3-dihydro-1H-pyridin-4-one?
The InChIKey is GGEIFIDWNQGZHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NOS/c1-7-5-8(12)6-9(11-7)10-3-2-4-13-10/h2-4,6-7,11H,5H2,1H3.
What are the key properties of 2-methyl-6-thiophen-2-yl-2,3-dihydro-1H-pyridin-4-one?
2-methyl-6-thiophen-2-yl-2,3-dihydro-1H-pyridin-4-one has a molecular weight of 193.27 g/mol, XLogP of 2.04, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-thiophen-2-yl-2,3-dihydro-1H-pyridin-4-one is sourced from PubChem (CID 10420132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).