6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-(2-piperidin-1-yl-1,3-dihydroinden-2-yl)methanone

C22H26N2OS — CID 42566424

IUPAC6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-(2-piperidin-1-yl-1,3-dihydroinden-2-yl)methanone
SMILESO=C(N1CCc2sccc2C1)C1(N2CCCCC2)Cc2ccccc2C1
InChIInChI=1S/C22H26N2OS/c25-21(23-12-8-20-19(16-23)9-13-26-20)22(24-10-4-1-5-11-24)14-17-6-2-3-7-18(17)15-22/h2-3,6-7,9,13H,1,4-5,8,10-12,14-16H2
InChIKeySEZVOPBCGHTATG-UHFFFAOYSA-N
MW366.53 g/mol
LogP3.66
Rot. Bonds2

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

6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-(2-piperidin-1-yl-1,3-dihydroinden-2-yl)methanone (PubChem CID 42566424) has the molecular formula C22H26N2OS and a molecular weight of 366.53 g/mol. Its IUPAC name is 6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-(2-piperidin-1-yl-1,3-dihydroinden-2-yl)methanone.

Molecular Properties

Compound Name6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-(2-piperidin-1-yl-1,3-dihydroinden-2-yl)methanone
PubChem CID42566424
Molecular FormulaC22H26N2OS
Molecular Weight366.53 g/mol
Exact Mass366.18
IUPAC Name6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-(2-piperidin-1-yl-1,3-dihydroinden-2-yl)methanone
SMILESO=C(N1CCc2sccc2C1)C1(N2CCCCC2)Cc2ccccc2C1
InChIInChI=1S/C22H26N2OS/c25-21(23-12-8-20-19(16-23)9-13-26-20)22(24-10-4-1-5-11-24)14-17-6-2-3-7-18(17)15-22/h2-3,6-7,9,13H,1,4-5,8,10-12,14-16H2
InChIKeySEZVOPBCGHTATG-UHFFFAOYSA-N
XLogP3.66
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.53
LogP ≤ 53.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-(2-piperidin-1-yl-1,3-dihydroinden-2-yl)methanone with MolForge

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Related Compounds

1-(6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carbonyl)cyclopentane-1-carbothioamide
CID 55037722
1-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-(2-hydroxyphenyl)ethanone
CID 78990761
1-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-hydroxy-2-phenylethanone
CID 111432209
2-(1-aminocyclobutyl)-1-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethanone
CID 79851562
3-(3,4-dihydro-1H-isoquinolin-2-yl)-1-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)propan-1-one
CID 56816880
6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-(3-methylpyrrolidin-3-yl)methanone;hydrochloride
CID 119700089
4-(6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carbonyl)benzoic acid
CID 43452700
[3-(3,4-dihydro-1H-isoquinolin-2-ylsulfonyl)thiophen-2-yl]-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)methanone
CID 30664840
N-[(1-phenylcyclopropyl)methyl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide
CID 18144092
N-[1-(2-chlorophenyl)ethyl]-6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carboxamide
CID 42934643
2-(cyclohexylamino)-1-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethanone
CID 43388465
1-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-3-hydroxy-3-phenylbutan-1-one
CID 110024514

Frequently Asked Questions

What is the IUPAC name of 6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-(2-piperidin-1-yl-1,3-dihydroinden-2-yl)methanone?
The IUPAC name of 6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-(2-piperidin-1-yl-1,3-dihydroinden-2-yl)methanone (CID 42566424) is 6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-(2-piperidin-1-yl-1,3-dihydroinden-2-yl)methanone.
What is the SMILES notation for 6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-(2-piperidin-1-yl-1,3-dihydroinden-2-yl)methanone?
The canonical SMILES for 6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-(2-piperidin-1-yl-1,3-dihydroinden-2-yl)methanone is O=C(N1CCc2sccc2C1)C1(N2CCCCC2)Cc2ccccc2C1.
What is the InChIKey of 6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-(2-piperidin-1-yl-1,3-dihydroinden-2-yl)methanone?
The InChIKey is SEZVOPBCGHTATG-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2OS/c25-21(23-12-8-20-19(16-23)9-13-26-20)22(24-10-4-1-5-11-24)14-17-6-2-3-7-18(17)15-22/h2-3,6-7,9,13H,1,4-5,8,10-12,14-16H2.
What are the key properties of 6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-(2-piperidin-1-yl-1,3-dihydroinden-2-yl)methanone?
6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-(2-piperidin-1-yl-1,3-dihydroinden-2-yl)methanone has a molecular weight of 366.53 g/mol, XLogP of 3.66, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl-(2-piperidin-1-yl-1,3-dihydroinden-2-yl)methanone is sourced from PubChem (CID 42566424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).