4-(1-benzylpiperidin-4-yl)-6,7-dihydrothieno[3,2-c]pyridine

C19H22N2S — CID 22458206

IUPAC4-(1-benzylpiperidin-4-yl)-6,7-dihydrothieno[3,2-c]pyridine
SMILESc1ccc(CN2CCC(C3=NCCc4sccc43)CC2)cc1
InChIInChI=1S/C19H22N2S/c1-2-4-15(5-3-1)14-21-11-7-16(8-12-21)19-17-9-13-22-18(17)6-10-20-19/h1-5,9,13,16H,6-8,10-12,14H2
InChIKeyJDGUAZVZGYKECR-UHFFFAOYSA-N
MW310.47 g/mol
LogP4.01
Rot. Bonds3

About 4-(1-benzylpiperidin-4-yl)-6,7-dihydrothieno[3,2-c]pyridine

4-(1-benzylpiperidin-4-yl)-6,7-dihydrothieno[3,2-c]pyridine (PubChem CID 22458206) has the molecular formula C19H22N2S and a molecular weight of 310.47 g/mol. Its IUPAC name is 4-(1-benzylpiperidin-4-yl)-6,7-dihydrothieno[3,2-c]pyridine.

Molecular Properties

Compound Name4-(1-benzylpiperidin-4-yl)-6,7-dihydrothieno[3,2-c]pyridine
PubChem CID22458206
Molecular FormulaC19H22N2S
Molecular Weight310.47 g/mol
Exact Mass310.15
IUPAC Name4-(1-benzylpiperidin-4-yl)-6,7-dihydrothieno[3,2-c]pyridine
SMILESc1ccc(CN2CCC(C3=NCCc4sccc43)CC2)cc1
InChIInChI=1S/C19H22N2S/c1-2-4-15(5-3-1)14-21-11-7-16(8-12-21)19-17-9-13-22-18(17)6-10-20-19/h1-5,9,13,16H,6-8,10-12,14H2
InChIKeyJDGUAZVZGYKECR-UHFFFAOYSA-N
XLogP4.01
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.47
LogP ≤ 54.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 11097616
1,4,7,10-tetrabenzyl-1,4,7,10-tetrazacyclododecane
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N-[[4-[(4-hydroxypiperidin-1-yl)methyl]phenyl]methyl]-3-phenylthiophene-2-carboxamide
CID 56552203
4-(1-benzylpyrrolidin-3-yl)pyridine
CID 11085844
1-benzyl-4-[4-(2-methylphenyl)-1H-pyrazol-5-yl]piperidine
CID 42165171
1-benzyl-N-methylpiperidin-4-amine
CID 4136128
CID 58171508
CID 58171508
(1-benzylpiperidin-4-yl)-dimethylazanium
CID 86306723
(1-benzylpiperidin-4-yl)methanethiol
CID 88901626
1-benzyl-4-(1,3-dioxolan-2-yl)piperidine
CID 72714001
1-benzylpiperidine-4-carbothioic S-acid
CID 154705821

Frequently Asked Questions

What is the IUPAC name of 4-(1-benzylpiperidin-4-yl)-6,7-dihydrothieno[3,2-c]pyridine?
The IUPAC name of 4-(1-benzylpiperidin-4-yl)-6,7-dihydrothieno[3,2-c]pyridine (CID 22458206) is 4-(1-benzylpiperidin-4-yl)-6,7-dihydrothieno[3,2-c]pyridine.
What is the SMILES notation for 4-(1-benzylpiperidin-4-yl)-6,7-dihydrothieno[3,2-c]pyridine?
The canonical SMILES for 4-(1-benzylpiperidin-4-yl)-6,7-dihydrothieno[3,2-c]pyridine is c1ccc(CN2CCC(C3=NCCc4sccc43)CC2)cc1.
What is the InChIKey of 4-(1-benzylpiperidin-4-yl)-6,7-dihydrothieno[3,2-c]pyridine?
The InChIKey is JDGUAZVZGYKECR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2S/c1-2-4-15(5-3-1)14-21-11-7-16(8-12-21)19-17-9-13-22-18(17)6-10-20-19/h1-5,9,13,16H,6-8,10-12,14H2.
What are the key properties of 4-(1-benzylpiperidin-4-yl)-6,7-dihydrothieno[3,2-c]pyridine?
4-(1-benzylpiperidin-4-yl)-6,7-dihydrothieno[3,2-c]pyridine has a molecular weight of 310.47 g/mol, XLogP of 4.01, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-benzylpiperidin-4-yl)-6,7-dihydrothieno[3,2-c]pyridine is sourced from PubChem (CID 22458206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).