4-methyl-6-phenyl-[1,2]thiazolo[5,4-b]pyridin-3-one

C13H10N2OS — CID 12933993

IUPAC4-methyl-6-phenyl-[1,2]thiazolo[5,4-b]pyridin-3-one
SMILESCc1cc(-c2ccccc2)nc2s[nH]c(=O)c12
InChIInChI=1S/C13H10N2OS/c1-8-7-10(9-5-3-2-4-6-9)14-13-11(8)12(16)15-17-13/h2-7H,1H3,(H,15,16)
InChIKeyJMWHDBHQOBJHOV-UHFFFAOYSA-N
MW242.30 g/mol
LogP2.96
Rot. Bonds1

About 4-methyl-6-phenyl-[1,2]thiazolo[5,4-b]pyridin-3-one

4-methyl-6-phenyl-[1,2]thiazolo[5,4-b]pyridin-3-one (PubChem CID 12933993) has the molecular formula C13H10N2OS and a molecular weight of 242.30 g/mol. Its IUPAC name is 4-methyl-6-phenyl-[1,2]thiazolo[5,4-b]pyridin-3-one.

Molecular Properties

Compound Name4-methyl-6-phenyl-[1,2]thiazolo[5,4-b]pyridin-3-one
PubChem CID12933993
Molecular FormulaC13H10N2OS
Molecular Weight242.30 g/mol
Exact Mass242.05
IUPAC Name4-methyl-6-phenyl-[1,2]thiazolo[5,4-b]pyridin-3-one
SMILESCc1cc(-c2ccccc2)nc2s[nH]c(=O)c12
InChIInChI=1S/C13H10N2OS/c1-8-7-10(9-5-3-2-4-6-9)14-13-11(8)12(16)15-17-13/h2-7H,1H3,(H,15,16)
InChIKeyJMWHDBHQOBJHOV-UHFFFAOYSA-N
XLogP2.96
TPSA45.75 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.30
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

13-methyl-5,11-diphenyl-4-sulfanylidene-8-thia-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),10,12-tetraen-6-one
CID 101005680
3-amino-N-(2-aminoethyl)-4-methyl-6-phenylthieno[2,3-b]pyridine-2-carboxamide
CID 102267908
8-methyl-6-phenyl-2H-2,7-naphthyridin-1-one
CID 11948308
8-methyl-3-phenyl-4-azatetracyclo[7.6.1.05,16.010,15]hexadeca-1,3,5(16),6,8,10,12,14-octaene
CID 59621802
3,4-dimethyl-6-phenylpyrazolo[3,4-b]pyridin-2-amine
CID 70626416
4-methyl-2-phenylbenzo[b][1,8]naphthyridin-5-amine
CID 151397277
4-(3,4-dimethylphenyl)-2-phenyl-1H-pyrimidin-6-one
CID 136692457
4-methyl-2-phenyl-1,7-naphthyridine
CID 71032237
3,4-dimethyl-6-phenylpyridazine
CID 14040320
2-(3,5-dimethyl-2-pyridinyl)-4-phenyl-1H-pyrimidin-6-one
CID 136914532
13-methyl-11-phenyl-4-piperazin-1-yl-6-propan-2-yloxy-8-thia-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
CID 11589820
7-methyl-5-phenyl-1H-pyrazolo[1,5-a]pyrimidin-2-one
CID 721644

Frequently Asked Questions

What is the IUPAC name of 4-methyl-6-phenyl-[1,2]thiazolo[5,4-b]pyridin-3-one?
The IUPAC name of 4-methyl-6-phenyl-[1,2]thiazolo[5,4-b]pyridin-3-one (CID 12933993) is 4-methyl-6-phenyl-[1,2]thiazolo[5,4-b]pyridin-3-one.
What is the SMILES notation for 4-methyl-6-phenyl-[1,2]thiazolo[5,4-b]pyridin-3-one?
The canonical SMILES for 4-methyl-6-phenyl-[1,2]thiazolo[5,4-b]pyridin-3-one is Cc1cc(-c2ccccc2)nc2s[nH]c(=O)c12.
What is the InChIKey of 4-methyl-6-phenyl-[1,2]thiazolo[5,4-b]pyridin-3-one?
The InChIKey is JMWHDBHQOBJHOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N2OS/c1-8-7-10(9-5-3-2-4-6-9)14-13-11(8)12(16)15-17-13/h2-7H,1H3,(H,15,16).
What are the key properties of 4-methyl-6-phenyl-[1,2]thiazolo[5,4-b]pyridin-3-one?
4-methyl-6-phenyl-[1,2]thiazolo[5,4-b]pyridin-3-one has a molecular weight of 242.30 g/mol, XLogP of 2.96, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-6-phenyl-[1,2]thiazolo[5,4-b]pyridin-3-one is sourced from PubChem (CID 12933993), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).