4-(4-fluorophenyl)-6-methyl-2-propyl-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride

C17H21ClFNS — CID 54581760

IUPAC4-(4-fluorophenyl)-6-methyl-2-propyl-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride
SMILESCCCc1cc2c(s1)CN(C)CC2c1ccc(F)cc1.Cl
InChIInChI=1S/C17H20FNS.ClH/c1-3-4-14-9-15-16(10-19(2)11-17(15)20-14)12-5-7-13(18)8-6-12;/h5-9,16H,3-4,10-11H2,1-2H3;1H
InChIKeyKUNXSFTZSGIEHA-UHFFFAOYSA-N
MW325.88 g/mol
LogP4.84
Rot. Bonds3

About 4-(4-fluorophenyl)-6-methyl-2-propyl-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride

4-(4-fluorophenyl)-6-methyl-2-propyl-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride (PubChem CID 54581760) has the molecular formula C17H21ClFNS and a molecular weight of 325.88 g/mol. Its IUPAC name is 4-(4-fluorophenyl)-6-methyl-2-propyl-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride.

Molecular Properties

Compound Name4-(4-fluorophenyl)-6-methyl-2-propyl-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride
PubChem CID54581760
Molecular FormulaC17H21ClFNS
Molecular Weight325.88 g/mol
Exact Mass325.11
IUPAC Name4-(4-fluorophenyl)-6-methyl-2-propyl-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride
SMILESCCCc1cc2c(s1)CN(C)CC2c1ccc(F)cc1.Cl
InChIInChI=1S/C17H20FNS.ClH/c1-3-4-14-9-15-16(10-19(2)11-17(15)20-14)12-5-7-13(18)8-6-12;/h5-9,16H,3-4,10-11H2,1-2H3;1H
InChIKeyKUNXSFTZSGIEHA-UHFFFAOYSA-N
XLogP4.84
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.88
LogP ≤ 54.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 4-(4-fluorophenyl)-6-methyl-2-propyl-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride with MolForge

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Related Compounds

Btcp
CID 123692
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Thionaphthene, 2-[1-(1-piperidyl)cyclopentyl]-
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1-(1-(5-(2'-Fluoroethyl)-2-thienyl)-cyclohexyl)piperidine
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1-(1-Benzothien-3-ylmethyl)piperidine
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5-[(2-methylphenyl)methyl]-6,7-dihydro-4H-thieno[3,2-c]pyridine
CID 3041293
2,6-Dimethyl-4-(p-bromophenyl)-4,5,6,7-tetrahydro-thieno[2,3-c]pyridine hydrochloride
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BTCP hydrochloride
CID 11957484
2-(4-(propan-2-yl)phenyl)-2-(4H,5H,6H,7H-thieno(3,2-c)pyridin-5-yl)ethan-1-amine
CID 43180384
4-(4-fluorophenyl)-4H,5H,6H,7H-thieno(3,2-c)pyridine
CID 42773975
(4-Benzylpiperazin-1-yl)-(5-methylthiophen-2-yl)methanethione
CID 2455027

Frequently Asked Questions

What is the IUPAC name of 4-(4-fluorophenyl)-6-methyl-2-propyl-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride?
The IUPAC name of 4-(4-fluorophenyl)-6-methyl-2-propyl-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride (CID 54581760) is 4-(4-fluorophenyl)-6-methyl-2-propyl-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride.
What is the SMILES notation for 4-(4-fluorophenyl)-6-methyl-2-propyl-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride?
The canonical SMILES for 4-(4-fluorophenyl)-6-methyl-2-propyl-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride is CCCc1cc2c(s1)CN(C)CC2c1ccc(F)cc1.Cl.
What is the InChIKey of 4-(4-fluorophenyl)-6-methyl-2-propyl-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride?
The InChIKey is KUNXSFTZSGIEHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20FNS.ClH/c1-3-4-14-9-15-16(10-19(2)11-17(15)20-14)12-5-7-13(18)8-6-12;/h5-9,16H,3-4,10-11H2,1-2H3;1H.
What are the key properties of 4-(4-fluorophenyl)-6-methyl-2-propyl-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride?
4-(4-fluorophenyl)-6-methyl-2-propyl-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride has a molecular weight of 325.88 g/mol, XLogP of 4.84, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-fluorophenyl)-6-methyl-2-propyl-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride is sourced from PubChem (CID 54581760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).