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

C10H10N2OS — CID 138982726

IUPAC3-amino-6-methyl-4-thiophen-2-yl-1H-pyridin-2-one
SMILESCc1cc(-c2cccs2)c(N)c(=O)[nH]1
InChIInChI=1S/C10H10N2OS/c1-6-5-7(8-3-2-4-14-8)9(11)10(13)12-6/h2-5H,11H2,1H3,(H,12,13)
InChIKeyDUENEHCWCZPZHL-UHFFFAOYSA-N
MW206.27 g/mol
LogP1.99
Rot. Bonds1

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

3-amino-6-methyl-4-thiophen-2-yl-1H-pyridin-2-one (PubChem CID 138982726) has the molecular formula C10H10N2OS and a molecular weight of 206.27 g/mol. Its IUPAC name is 3-amino-6-methyl-4-thiophen-2-yl-1H-pyridin-2-one.

Molecular Properties

Compound Name3-amino-6-methyl-4-thiophen-2-yl-1H-pyridin-2-one
PubChem CID138982726
Molecular FormulaC10H10N2OS
Molecular Weight206.27 g/mol
Exact Mass206.05
IUPAC Name3-amino-6-methyl-4-thiophen-2-yl-1H-pyridin-2-one
SMILESCc1cc(-c2cccs2)c(N)c(=O)[nH]1
InChIInChI=1S/C10H10N2OS/c1-6-5-7(8-3-2-4-14-8)9(11)10(13)12-6/h2-5H,11H2,1H3,(H,12,13)
InChIKeyDUENEHCWCZPZHL-UHFFFAOYSA-N
XLogP1.99
TPSA58.88 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.27
LogP ≤ 51.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-amino-6-methyl-4-thiophen-2-yl-1H-pyridin-2-one?
The IUPAC name of 3-amino-6-methyl-4-thiophen-2-yl-1H-pyridin-2-one (CID 138982726) is 3-amino-6-methyl-4-thiophen-2-yl-1H-pyridin-2-one.
What is the SMILES notation for 3-amino-6-methyl-4-thiophen-2-yl-1H-pyridin-2-one?
The canonical SMILES for 3-amino-6-methyl-4-thiophen-2-yl-1H-pyridin-2-one is Cc1cc(-c2cccs2)c(N)c(=O)[nH]1.
What is the InChIKey of 3-amino-6-methyl-4-thiophen-2-yl-1H-pyridin-2-one?
The InChIKey is DUENEHCWCZPZHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2OS/c1-6-5-7(8-3-2-4-14-8)9(11)10(13)12-6/h2-5H,11H2,1H3,(H,12,13).
What are the key properties of 3-amino-6-methyl-4-thiophen-2-yl-1H-pyridin-2-one?
3-amino-6-methyl-4-thiophen-2-yl-1H-pyridin-2-one has a molecular weight of 206.27 g/mol, XLogP of 1.99, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-6-methyl-4-thiophen-2-yl-1H-pyridin-2-one is sourced from PubChem (CID 138982726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).