2-(2-chlorophenyl)-6,7-dihydrothieno[3,2-c]pyridine

C13H10ClNS — CID 142934759

IUPAC2-(2-chlorophenyl)-6,7-dihydrothieno[3,2-c]pyridine
SMILESClc1ccccc1-c1cc2c(s1)CCN=C2
InChIInChI=1S/C13H10ClNS/c14-11-4-2-1-3-10(11)13-7-9-8-15-6-5-12(9)16-13/h1-4,7-8H,5-6H2
InChIKeyVPWMUHSRHRGRKM-UHFFFAOYSA-N
MW247.75 g/mol
LogP4.04
Rot. Bonds1

About 2-(2-chlorophenyl)-6,7-dihydrothieno[3,2-c]pyridine

2-(2-chlorophenyl)-6,7-dihydrothieno[3,2-c]pyridine (PubChem CID 142934759) has the molecular formula C13H10ClNS and a molecular weight of 247.75 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-6,7-dihydrothieno[3,2-c]pyridine.

Molecular Properties

Compound Name2-(2-chlorophenyl)-6,7-dihydrothieno[3,2-c]pyridine
PubChem CID142934759
Molecular FormulaC13H10ClNS
Molecular Weight247.75 g/mol
Exact Mass247.02
IUPAC Name2-(2-chlorophenyl)-6,7-dihydrothieno[3,2-c]pyridine
SMILESClc1ccccc1-c1cc2c(s1)CCN=C2
InChIInChI=1S/C13H10ClNS/c14-11-4-2-1-3-10(11)13-7-9-8-15-6-5-12(9)16-13/h1-4,7-8H,5-6H2
InChIKeyVPWMUHSRHRGRKM-UHFFFAOYSA-N
XLogP4.04
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.75
LogP ≤ 54.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)-6,7-dihydrothieno[3,2-c]pyridine?
The IUPAC name of 2-(2-chlorophenyl)-6,7-dihydrothieno[3,2-c]pyridine (CID 142934759) is 2-(2-chlorophenyl)-6,7-dihydrothieno[3,2-c]pyridine.
What is the SMILES notation for 2-(2-chlorophenyl)-6,7-dihydrothieno[3,2-c]pyridine?
The canonical SMILES for 2-(2-chlorophenyl)-6,7-dihydrothieno[3,2-c]pyridine is Clc1ccccc1-c1cc2c(s1)CCN=C2.
What is the InChIKey of 2-(2-chlorophenyl)-6,7-dihydrothieno[3,2-c]pyridine?
The InChIKey is VPWMUHSRHRGRKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10ClNS/c14-11-4-2-1-3-10(11)13-7-9-8-15-6-5-12(9)16-13/h1-4,7-8H,5-6H2.
What are the key properties of 2-(2-chlorophenyl)-6,7-dihydrothieno[3,2-c]pyridine?
2-(2-chlorophenyl)-6,7-dihydrothieno[3,2-c]pyridine has a molecular weight of 247.75 g/mol, XLogP of 4.04, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)-6,7-dihydrothieno[3,2-c]pyridine is sourced from PubChem (CID 142934759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).