1-[2-(methylamino)-[1,3]thiazolo[4,5-c]pyridin-6-yl]ethanone

C9H9N3OS — CID 130047694

IUPAC1-[2-(methylamino)-[1,3]thiazolo[4,5-c]pyridin-6-yl]ethanone
SMILESCNc1nc2cnc(C(C)=O)cc2s1
InChIInChI=1S/C9H9N3OS/c1-5(13)6-3-8-7(4-11-6)12-9(10-2)14-8/h3-4H,1-2H3,(H,10,12)
InChIKeyMQGVJSXPWQOOSO-UHFFFAOYSA-N
MW207.26 g/mol
LogP1.94
Rot. Bonds2

About 1-[2-(methylamino)-[1,3]thiazolo[4,5-c]pyridin-6-yl]ethanone

1-[2-(methylamino)-[1,3]thiazolo[4,5-c]pyridin-6-yl]ethanone (PubChem CID 130047694) has the molecular formula C9H9N3OS and a molecular weight of 207.26 g/mol. Its IUPAC name is 1-[2-(methylamino)-[1,3]thiazolo[4,5-c]pyridin-6-yl]ethanone.

Molecular Properties

Compound Name1-[2-(methylamino)-[1,3]thiazolo[4,5-c]pyridin-6-yl]ethanone
PubChem CID130047694
Molecular FormulaC9H9N3OS
Molecular Weight207.26 g/mol
Exact Mass207.05
IUPAC Name1-[2-(methylamino)-[1,3]thiazolo[4,5-c]pyridin-6-yl]ethanone
SMILESCNc1nc2cnc(C(C)=O)cc2s1
InChIInChI=1S/C9H9N3OS/c1-5(13)6-3-8-7(4-11-6)12-9(10-2)14-8/h3-4H,1-2H3,(H,10,12)
InChIKeyMQGVJSXPWQOOSO-UHFFFAOYSA-N
XLogP1.94
TPSA54.88 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 ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(methylamino)-1,3-benzothiazole-5-carboxylic acid
CID 18377605
ethyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]-[1,3]thiazolo[4,5-c]pyridine-6-carboxylate
CID 170948135
1-pyrido[3,4-b]pyrazin-7-ylethanone
CID 154727194
3-[2-(methylamino)-1,3-benzothiazol-6-yl]propanoic acid
CID 82548532
6-chloro-N-methyl-1,3-benzothiazol-2-amine
CID 10774358
6-bromo-N,5-dimethyl-1,3-benzothiazol-2-amine
CID 82549197
N-[6-(5-methylsulfonyl-3-pyridinyl)-[1,3]thiazolo[4,5-c]pyridin-2-yl]acetamide
CID 46932541
N-(1,3-benzothiazol-2-yl)-5-(methylamino)pyridine-2-carboxamide
CID 104639786
2-N,5-N-bis(6-methyl-1,3-benzothiazol-2-yl)pyridine-2,5-dicarboxamide
CID 4652334
2-acetylthieno[2,3-c]pyridine-5-carboxylic acid
CID 82392482
N-(6-methyl-[1,3]thiazolo[4,5-c]pyridin-2-yl)-1H-pyrazole-5-carboxamide
CID 130354570
acetaldehyde;6-(6-amino-3-pyridinyl)-N-methyl-1,3-benzothiazol-2-amine;ethane
CID 143527879

Frequently Asked Questions

What is the IUPAC name of 1-[2-(methylamino)-[1,3]thiazolo[4,5-c]pyridin-6-yl]ethanone?
The IUPAC name of 1-[2-(methylamino)-[1,3]thiazolo[4,5-c]pyridin-6-yl]ethanone (CID 130047694) is 1-[2-(methylamino)-[1,3]thiazolo[4,5-c]pyridin-6-yl]ethanone.
What is the SMILES notation for 1-[2-(methylamino)-[1,3]thiazolo[4,5-c]pyridin-6-yl]ethanone?
The canonical SMILES for 1-[2-(methylamino)-[1,3]thiazolo[4,5-c]pyridin-6-yl]ethanone is CNc1nc2cnc(C(C)=O)cc2s1.
What is the InChIKey of 1-[2-(methylamino)-[1,3]thiazolo[4,5-c]pyridin-6-yl]ethanone?
The InChIKey is MQGVJSXPWQOOSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3OS/c1-5(13)6-3-8-7(4-11-6)12-9(10-2)14-8/h3-4H,1-2H3,(H,10,12).
What are the key properties of 1-[2-(methylamino)-[1,3]thiazolo[4,5-c]pyridin-6-yl]ethanone?
1-[2-(methylamino)-[1,3]thiazolo[4,5-c]pyridin-6-yl]ethanone has a molecular weight of 207.26 g/mol, XLogP of 1.94, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(methylamino)-[1,3]thiazolo[4,5-c]pyridin-6-yl]ethanone is sourced from PubChem (CID 130047694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).