6-methyl-1-[[5-(methylamino)thiadiazol-4-yl]methyl]pyridin-2-one

C10H12N4OS — CID 62193449

IUPAC6-methyl-1-[[5-(methylamino)thiadiazol-4-yl]methyl]pyridin-2-one
SMILESCNc1snnc1Cn1c(C)cccc1=O
InChIInChI=1S/C10H12N4OS/c1-7-4-3-5-9(15)14(7)6-8-10(11-2)16-13-12-8/h3-5,11H,6H2,1-2H3
InChIKeyZQBUKWFGGMLNEO-UHFFFAOYSA-N
MW236.30 g/mol
LogP1.10
Rot. Bonds3

About 6-methyl-1-[[5-(methylamino)thiadiazol-4-yl]methyl]pyridin-2-one

6-methyl-1-[[5-(methylamino)thiadiazol-4-yl]methyl]pyridin-2-one (PubChem CID 62193449) has the molecular formula C10H12N4OS and a molecular weight of 236.30 g/mol. Its IUPAC name is 6-methyl-1-[[5-(methylamino)thiadiazol-4-yl]methyl]pyridin-2-one.

Molecular Properties

Compound Name6-methyl-1-[[5-(methylamino)thiadiazol-4-yl]methyl]pyridin-2-one
PubChem CID62193449
Molecular FormulaC10H12N4OS
Molecular Weight236.30 g/mol
Exact Mass236.07
IUPAC Name6-methyl-1-[[5-(methylamino)thiadiazol-4-yl]methyl]pyridin-2-one
SMILESCNc1snnc1Cn1c(C)cccc1=O
InChIInChI=1S/C10H12N4OS/c1-7-4-3-5-9(15)14(7)6-8-10(11-2)16-13-12-8/h3-5,11H,6H2,1-2H3
InChIKeyZQBUKWFGGMLNEO-UHFFFAOYSA-N
XLogP1.10
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.30
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-1-[[5-(methylamino)thiadiazol-4-yl]methyl]pyridin-2-one?
The IUPAC name of 6-methyl-1-[[5-(methylamino)thiadiazol-4-yl]methyl]pyridin-2-one (CID 62193449) is 6-methyl-1-[[5-(methylamino)thiadiazol-4-yl]methyl]pyridin-2-one.
What is the SMILES notation for 6-methyl-1-[[5-(methylamino)thiadiazol-4-yl]methyl]pyridin-2-one?
The canonical SMILES for 6-methyl-1-[[5-(methylamino)thiadiazol-4-yl]methyl]pyridin-2-one is CNc1snnc1Cn1c(C)cccc1=O.
What is the InChIKey of 6-methyl-1-[[5-(methylamino)thiadiazol-4-yl]methyl]pyridin-2-one?
The InChIKey is ZQBUKWFGGMLNEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4OS/c1-7-4-3-5-9(15)14(7)6-8-10(11-2)16-13-12-8/h3-5,11H,6H2,1-2H3.
What are the key properties of 6-methyl-1-[[5-(methylamino)thiadiazol-4-yl]methyl]pyridin-2-one?
6-methyl-1-[[5-(methylamino)thiadiazol-4-yl]methyl]pyridin-2-one has a molecular weight of 236.30 g/mol, XLogP of 1.10, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-1-[[5-(methylamino)thiadiazol-4-yl]methyl]pyridin-2-one is sourced from PubChem (CID 62193449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).