4-amino-5,6-dihydro-4H-[1,2]thiazolo[5,4-c]pyridin-7-one

C6H7N3OS — CID 82412833

IUPAC4-amino-5,6-dihydro-4H-[1,2]thiazolo[5,4-c]pyridin-7-one
SMILESNC1CNC(=O)c2sncc21
InChIInChI=1S/C6H7N3OS/c7-4-2-8-6(10)5-3(4)1-9-11-5/h1,4H,2,7H2,(H,8,10)
InChIKeyMFBZINULPVTQRW-UHFFFAOYSA-N
MW169.21 g/mol
LogP-0.11
Rot. Bonds

About 4-amino-5,6-dihydro-4H-[1,2]thiazolo[5,4-c]pyridin-7-one

4-amino-5,6-dihydro-4H-[1,2]thiazolo[5,4-c]pyridin-7-one (PubChem CID 82412833) has the molecular formula C6H7N3OS and a molecular weight of 169.21 g/mol. Its IUPAC name is 4-amino-5,6-dihydro-4H-[1,2]thiazolo[5,4-c]pyridin-7-one.

Molecular Properties

Compound Name4-amino-5,6-dihydro-4H-[1,2]thiazolo[5,4-c]pyridin-7-one
PubChem CID82412833
Molecular FormulaC6H7N3OS
Molecular Weight169.21 g/mol
Exact Mass169.03
IUPAC Name4-amino-5,6-dihydro-4H-[1,2]thiazolo[5,4-c]pyridin-7-one
SMILESNC1CNC(=O)c2sncc21
InChIInChI=1S/C6H7N3OS/c7-4-2-8-6(10)5-3(4)1-9-11-5/h1,4H,2,7H2,(H,8,10)
InChIKeyMFBZINULPVTQRW-UHFFFAOYSA-N
XLogP-0.11
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.21
LogP ≤ 5-0.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5,6-dihydro-4H-[1,2]thiazolo[5,4-c]pyridin-7-one
CID 168137730
4-Amino-3,6-dimethyl-4,5-dihydro-[1,2]thiazolo[5,4-c]pyridin-7-one
CID 82398796
4-amino-3-methyl-5,6-dihydro-4H-[1,2]thiazolo[5,4-c]pyridin-7-one
CID 82407132

Frequently Asked Questions

What is the IUPAC name of 4-amino-5,6-dihydro-4H-[1,2]thiazolo[5,4-c]pyridin-7-one?
The IUPAC name of 4-amino-5,6-dihydro-4H-[1,2]thiazolo[5,4-c]pyridin-7-one (CID 82412833) is 4-amino-5,6-dihydro-4H-[1,2]thiazolo[5,4-c]pyridin-7-one.
What is the SMILES notation for 4-amino-5,6-dihydro-4H-[1,2]thiazolo[5,4-c]pyridin-7-one?
The canonical SMILES for 4-amino-5,6-dihydro-4H-[1,2]thiazolo[5,4-c]pyridin-7-one is NC1CNC(=O)c2sncc21.
What is the InChIKey of 4-amino-5,6-dihydro-4H-[1,2]thiazolo[5,4-c]pyridin-7-one?
The InChIKey is MFBZINULPVTQRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7N3OS/c7-4-2-8-6(10)5-3(4)1-9-11-5/h1,4H,2,7H2,(H,8,10).
What are the key properties of 4-amino-5,6-dihydro-4H-[1,2]thiazolo[5,4-c]pyridin-7-one?
4-amino-5,6-dihydro-4H-[1,2]thiazolo[5,4-c]pyridin-7-one has a molecular weight of 169.21 g/mol, XLogP of -0.11, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-5,6-dihydro-4H-[1,2]thiazolo[5,4-c]pyridin-7-one is sourced from PubChem (CID 82412833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).