3-(methylamino)-1-(1,3-thiazol-2-yl)pyridin-2-one

C9H9N3OS — CID 139373498

IUPAC3-(methylamino)-1-(1,3-thiazol-2-yl)pyridin-2-one
SMILESCNc1cccn(-c2nccs2)c1=O
InChIInChI=1S/C9H9N3OS/c1-10-7-3-2-5-12(8(7)13)9-11-4-6-14-9/h2-6,10H,1H3
InChIKeyIPDJBZFREBKRAQ-UHFFFAOYSA-N
MW207.26 g/mol
LogP1.34
Rot. Bonds2

About 3-(methylamino)-1-(1,3-thiazol-2-yl)pyridin-2-one

3-(methylamino)-1-(1,3-thiazol-2-yl)pyridin-2-one (PubChem CID 139373498) has the molecular formula C9H9N3OS and a molecular weight of 207.26 g/mol. Its IUPAC name is 3-(methylamino)-1-(1,3-thiazol-2-yl)pyridin-2-one.

Molecular Properties

Compound Name3-(methylamino)-1-(1,3-thiazol-2-yl)pyridin-2-one
PubChem CID139373498
Molecular FormulaC9H9N3OS
Molecular Weight207.26 g/mol
Exact Mass207.05
IUPAC Name3-(methylamino)-1-(1,3-thiazol-2-yl)pyridin-2-one
SMILESCNc1cccn(-c2nccs2)c1=O
InChIInChI=1S/C9H9N3OS/c1-10-7-3-2-5-12(8(7)13)9-11-4-6-14-9/h2-6,10H,1H3
InChIKeyIPDJBZFREBKRAQ-UHFFFAOYSA-N
XLogP1.34
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.26
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-(methylamino)-1-(1,3-thiazol-2-yl)pyridin-2-one?
The IUPAC name of 3-(methylamino)-1-(1,3-thiazol-2-yl)pyridin-2-one (CID 139373498) is 3-(methylamino)-1-(1,3-thiazol-2-yl)pyridin-2-one.
What is the SMILES notation for 3-(methylamino)-1-(1,3-thiazol-2-yl)pyridin-2-one?
The canonical SMILES for 3-(methylamino)-1-(1,3-thiazol-2-yl)pyridin-2-one is CNc1cccn(-c2nccs2)c1=O.
What is the InChIKey of 3-(methylamino)-1-(1,3-thiazol-2-yl)pyridin-2-one?
The InChIKey is IPDJBZFREBKRAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3OS/c1-10-7-3-2-5-12(8(7)13)9-11-4-6-14-9/h2-6,10H,1H3.
What are the key properties of 3-(methylamino)-1-(1,3-thiazol-2-yl)pyridin-2-one?
3-(methylamino)-1-(1,3-thiazol-2-yl)pyridin-2-one has a molecular weight of 207.26 g/mol, XLogP of 1.34, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methylamino)-1-(1,3-thiazol-2-yl)pyridin-2-one is sourced from PubChem (CID 139373498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).