4-(4-methoxyphenyl)-2,6-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride

C16H20ClNOS — CID 54586591

IUPAC4-(4-methoxyphenyl)-2,6-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride
SMILESCOc1ccc(C2CN(C)Cc3sc(C)cc32)cc1.Cl
InChIInChI=1S/C16H19NOS.ClH/c1-11-8-14-15(9-17(2)10-16(14)19-11)12-4-6-13(18-3)7-5-12;/h4-8,15H,9-10H2,1-3H3;1H
InChIKeyYQPSEDNNMISNJV-UHFFFAOYSA-N
MW309.86 g/mol
LogP4.06
Rot. Bonds2

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

4-(4-methoxyphenyl)-2,6-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride (PubChem CID 54586591) has the molecular formula C16H20ClNOS and a molecular weight of 309.86 g/mol. Its IUPAC name is 4-(4-methoxyphenyl)-2,6-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride.

Molecular Properties

Compound Name4-(4-methoxyphenyl)-2,6-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride
PubChem CID54586591
Molecular FormulaC16H20ClNOS
Molecular Weight309.86 g/mol
Exact Mass309.10
IUPAC Name4-(4-methoxyphenyl)-2,6-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride
SMILESCOc1ccc(C2CN(C)Cc3sc(C)cc32)cc1.Cl
InChIInChI=1S/C16H19NOS.ClH/c1-11-8-14-15(9-17(2)10-16(14)19-11)12-4-6-13(18-3)7-5-12;/h4-8,15H,9-10H2,1-3H3;1H
InChIKeyYQPSEDNNMISNJV-UHFFFAOYSA-N
XLogP4.06
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.86
LogP ≤ 54.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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

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Related Compounds

1-[4-(4-Methoxyphenyl)-4,5,6,7-tetrahydrothieno[3,2-c]pyridin-5-yl]ethan-1-one
CID 2739545
1-[4-(4-methoxyphenyl)-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-2,2-dimethylpropan-1-one
CID 2739546
{3-(3-Methoxybenzyl)-1-[(5-methyl-2-thienyl)methyl]piperidin-3-yl}methanol
CID 16191004
4-(2,6-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-4-yl)phenol;hydrochloride
CID 54581729
4-(3,4-dimethoxyphenyl)-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride
CID 54583693
1'-Benzyl-1-(4-methoxyphenyl)spiro[6,7-dihydrothieno[3,4-c]pyran-4,4'-piperidine]
CID 56651873
1-[3-(4-Thiophen-2-ylphenoxy)propyl]piperidine
CID 56668427
1'-Benzyl-6-methoxy-2-(4-methoxyphenyl)spiro[6,7-dihydrothieno[3,2-c]pyran-4,4'-piperidine]
CID 70677091
1'-Benzyl-5-methoxy-2-(4-methoxyphenyl)spiro[4,5-dihydrothieno[2,3-c]pyran-7,4'-piperidine]
CID 70677247
1'-[(4-Phenoxyphenyl)methyl]spiro[6,7-dihydrothieno[3,2-c]pyran-4,4'-piperidine]
CID 145991946
[2-(4-Methoxy-phenyl)-ethyl]-(3-methyl-thiophen-2-ylmethyl)-amine
CID 6473116
4-(4-Methoxyphenyl)-4,5,6,7-tetrahydrothieno[3,2-c]pyridine
CID 2736769

Frequently Asked Questions

What is the IUPAC name of 4-(4-methoxyphenyl)-2,6-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride?
The IUPAC name of 4-(4-methoxyphenyl)-2,6-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride (CID 54586591) is 4-(4-methoxyphenyl)-2,6-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride.
What is the SMILES notation for 4-(4-methoxyphenyl)-2,6-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride?
The canonical SMILES for 4-(4-methoxyphenyl)-2,6-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride is COc1ccc(C2CN(C)Cc3sc(C)cc32)cc1.Cl.
What is the InChIKey of 4-(4-methoxyphenyl)-2,6-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride?
The InChIKey is YQPSEDNNMISNJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NOS.ClH/c1-11-8-14-15(9-17(2)10-16(14)19-11)12-4-6-13(18-3)7-5-12;/h4-8,15H,9-10H2,1-3H3;1H.
What are the key properties of 4-(4-methoxyphenyl)-2,6-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride?
4-(4-methoxyphenyl)-2,6-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride has a molecular weight of 309.86 g/mol, XLogP of 4.06, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methoxyphenyl)-2,6-dimethyl-5,7-dihydro-4H-thieno[2,3-c]pyridine;hydrochloride is sourced from PubChem (CID 54586591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).