3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)cyclopentan-1-one

C12H15NOS — CID 79642921

IUPAC3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)cyclopentan-1-one
SMILESO=C1CCC(N2CCc3sccc3C2)C1
InChIInChI=1S/C12H15NOS/c14-11-2-1-10(7-11)13-5-3-12-9(8-13)4-6-15-12/h4,6,10H,1-3,5,7-8H2
InChIKeyZHJOJRKIPGXDOQ-UHFFFAOYSA-N
MW221.32 g/mol
LogP2.23
Rot. Bonds1

About 3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)cyclopentan-1-one

3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)cyclopentan-1-one (PubChem CID 79642921) has the molecular formula C12H15NOS and a molecular weight of 221.32 g/mol. Its IUPAC name is 3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)cyclopentan-1-one.

Molecular Properties

Compound Name3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)cyclopentan-1-one
PubChem CID79642921
Molecular FormulaC12H15NOS
Molecular Weight221.32 g/mol
Exact Mass221.09
IUPAC Name3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)cyclopentan-1-one
SMILESO=C1CCC(N2CCc3sccc3C2)C1
InChIInChI=1S/C12H15NOS/c14-11-2-1-10(7-11)13-5-3-12-9(8-13)4-6-15-12/h4,6,10H,1-3,5,7-8H2
InChIKeyZHJOJRKIPGXDOQ-UHFFFAOYSA-N
XLogP2.23
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.32
LogP ≤ 52.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)oxolan-2-one
CID 42941023
cis-(1S,2R)-2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)cyclohexan-1-ol
CID 129365586
1-[4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)piperidin-1-yl]-2,2-dimethylpropan-1-one
CID 91625159
6-[3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)azetidine-1-carbonyl]-2-methylpyridazin-3-one
CID 121017174
1-[3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)azetidin-1-yl]-2,2-dimethylpropan-1-one
CID 121154228
3-[4-(1,3-thiazol-2-yl)piperazin-1-yl]cyclopentan-1-one
CID 79643158
5-(1-pyrimidin-2-ylazetidin-3-yl)-6,7-dihydro-4H-thieno[3,2-c]pyridine
CID 138988858
5-(1-thiophen-2-ylsulfonylazetidin-3-yl)-6,7-dihydro-4H-thieno[3,2-c]pyridine
CID 121154557
1-[4-[3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)azetidine-1-carbonyl]piperidin-1-yl]ethanone;hydrochloride
CID 121154421
[2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)cyclopentyl]methanamine
CID 43530847
5-[1-(2,5-dimethylphenyl)sulfonylazetidin-3-yl]-6,7-dihydro-4H-thieno[3,2-c]pyridine
CID 121154569
5-[1-[4-(1,2,4-triazol-1-yl)phenyl]piperidin-4-yl]-6,7-dihydro-4H-thieno[3,2-c]pyridine
CID 56860748

Frequently Asked Questions

What is the IUPAC name of 3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)cyclopentan-1-one?
The IUPAC name of 3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)cyclopentan-1-one (CID 79642921) is 3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)cyclopentan-1-one.
What is the SMILES notation for 3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)cyclopentan-1-one?
The canonical SMILES for 3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)cyclopentan-1-one is O=C1CCC(N2CCc3sccc3C2)C1.
What is the InChIKey of 3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)cyclopentan-1-one?
The InChIKey is ZHJOJRKIPGXDOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NOS/c14-11-2-1-10(7-11)13-5-3-12-9(8-13)4-6-15-12/h4,6,10H,1-3,5,7-8H2.
What are the key properties of 3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)cyclopentan-1-one?
3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)cyclopentan-1-one has a molecular weight of 221.32 g/mol, XLogP of 2.23, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)cyclopentan-1-one is sourced from PubChem (CID 79642921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).