7aH-thieno[2,3-c]pyridin-7-one

C7H5NOS — CID 76845842

IUPAC7aH-thieno[2,3-c]pyridin-7-one
SMILESO=C1N=CC=C2C=CSC12
InChIInChI=1S/C7H5NOS/c9-7-6-5(1-3-8-7)2-4-10-6/h1-4,6H
InChIKeyCDSNLYMVKXTFQX-UHFFFAOYSA-N
MW151.19 g/mol
LogP1.15
Rot. Bonds

About 7aH-thieno[2,3-c]pyridin-7-one

7aH-thieno[2,3-c]pyridin-7-one (PubChem CID 76845842) has the molecular formula C7H5NOS and a molecular weight of 151.19 g/mol. Its IUPAC name is 7aH-thieno[2,3-c]pyridin-7-one.

Molecular Properties

Compound Name7aH-thieno[2,3-c]pyridin-7-one
PubChem CID76845842
Molecular FormulaC7H5NOS
Molecular Weight151.19 g/mol
Exact Mass151.01
IUPAC Name7aH-thieno[2,3-c]pyridin-7-one
SMILESO=C1N=CC=C2C=CSC12
InChIInChI=1S/C7H5NOS/c9-7-6-5(1-3-8-7)2-4-10-6/h1-4,6H
InChIKeyCDSNLYMVKXTFQX-UHFFFAOYSA-N
XLogP1.15
TPSA29.43 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.19
LogP ≤ 51.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

7-amino-8aH-isoquinolin-1-one
CID 71651027
6aH-thieno[2,3-b]pyrrole
CID 123991282
(8aS)-1-oxo-8aH-isoquinoline-6-carboxylic acid
CID 129407549
7aH-thieno[3,2-b]pyridin-7-one
CID 71304750
3-bromo-3aH-thieno[3,2-c]pyridin-4-one
CID 73446382
3-(aminomethyl)-4-methyl-3H-pyridin-2-one;hydrochloride
CID 76847940
4a,8a-dihydrothiopyrano[2,3-b]pyridin-4-one
CID 22224514
7-(4-methylpiperidin-1-yl)-8aH-isoquinolin-1-one
CID 156594946
3-chloropyrrol-2-one
CID 151737399
(3-oxothiophen-2-yl)boronic acid
CID 70229964
8aH-pyrido[4,3-e][1,2,4]triazin-8-one
CID 75088779
2-chlorothiophen-3-one
CID 89128659

Frequently Asked Questions

What is the IUPAC name of 7aH-thieno[2,3-c]pyridin-7-one?
The IUPAC name of 7aH-thieno[2,3-c]pyridin-7-one (CID 76845842) is 7aH-thieno[2,3-c]pyridin-7-one.
What is the SMILES notation for 7aH-thieno[2,3-c]pyridin-7-one?
The canonical SMILES for 7aH-thieno[2,3-c]pyridin-7-one is O=C1N=CC=C2C=CSC12.
What is the InChIKey of 7aH-thieno[2,3-c]pyridin-7-one?
The InChIKey is CDSNLYMVKXTFQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5NOS/c9-7-6-5(1-3-8-7)2-4-10-6/h1-4,6H.
What are the key properties of 7aH-thieno[2,3-c]pyridin-7-one?
7aH-thieno[2,3-c]pyridin-7-one has a molecular weight of 151.19 g/mol, XLogP of 1.15, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7aH-thieno[2,3-c]pyridin-7-one is sourced from PubChem (CID 76845842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).