1-methyl-3-(1,3-thiazol-2-ylamino)pyridin-2-one

C9H9N3OS — CID 141210565

IUPAC1-methyl-3-(1,3-thiazol-2-ylamino)pyridin-2-one
SMILESCn1cccc(Nc2nccs2)c1=O
InChIInChI=1S/C9H9N3OS/c1-12-5-2-3-7(8(12)13)11-9-10-4-6-14-9/h2-6H,1H3,(H,10,11)
InChIKeyXFUFCBLZQGBLEY-UHFFFAOYSA-N
MW207.26 g/mol
LogP1.59
Rot. Bonds2

About 1-methyl-3-(1,3-thiazol-2-ylamino)pyridin-2-one

1-methyl-3-(1,3-thiazol-2-ylamino)pyridin-2-one (PubChem CID 141210565) has the molecular formula C9H9N3OS and a molecular weight of 207.26 g/mol. Its IUPAC name is 1-methyl-3-(1,3-thiazol-2-ylamino)pyridin-2-one.

Molecular Properties

Compound Name1-methyl-3-(1,3-thiazol-2-ylamino)pyridin-2-one
PubChem CID141210565
Molecular FormulaC9H9N3OS
Molecular Weight207.26 g/mol
Exact Mass207.05
IUPAC Name1-methyl-3-(1,3-thiazol-2-ylamino)pyridin-2-one
SMILESCn1cccc(Nc2nccs2)c1=O
InChIInChI=1S/C9H9N3OS/c1-12-5-2-3-7(8(12)13)11-9-10-4-6-14-9/h2-6H,1H3,(H,10,11)
InChIKeyXFUFCBLZQGBLEY-UHFFFAOYSA-N
XLogP1.59
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 ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-(1,3-thiazol-2-ylamino)pyridin-2-one?
The IUPAC name of 1-methyl-3-(1,3-thiazol-2-ylamino)pyridin-2-one (CID 141210565) is 1-methyl-3-(1,3-thiazol-2-ylamino)pyridin-2-one.
What is the SMILES notation for 1-methyl-3-(1,3-thiazol-2-ylamino)pyridin-2-one?
The canonical SMILES for 1-methyl-3-(1,3-thiazol-2-ylamino)pyridin-2-one is Cn1cccc(Nc2nccs2)c1=O.
What is the InChIKey of 1-methyl-3-(1,3-thiazol-2-ylamino)pyridin-2-one?
The InChIKey is XFUFCBLZQGBLEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3OS/c1-12-5-2-3-7(8(12)13)11-9-10-4-6-14-9/h2-6H,1H3,(H,10,11).
What are the key properties of 1-methyl-3-(1,3-thiazol-2-ylamino)pyridin-2-one?
1-methyl-3-(1,3-thiazol-2-ylamino)pyridin-2-one has a molecular weight of 207.26 g/mol, XLogP of 1.59, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-(1,3-thiazol-2-ylamino)pyridin-2-one is sourced from PubChem (CID 141210565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).