7-(2-fluoro-4,5-dimethoxyphenyl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine

C15H16FNO2S — CID 19959701

IUPAC7-(2-fluoro-4,5-dimethoxyphenyl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine
SMILESCOc1cc(F)c(C2NCCc3ccsc32)cc1OC
InChIInChI=1S/C15H16FNO2S/c1-18-12-7-10(11(16)8-13(12)19-2)14-15-9(3-5-17-14)4-6-20-15/h4,6-8,14,17H,3,5H2,1-2H3
InChIKeyDTNZRJPICAGEIT-UHFFFAOYSA-N
MW293.36 g/mol
LogP3.14
Rot. Bonds3

About 7-(2-fluoro-4,5-dimethoxyphenyl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine

7-(2-fluoro-4,5-dimethoxyphenyl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine (PubChem CID 19959701) has the molecular formula C15H16FNO2S and a molecular weight of 293.36 g/mol. Its IUPAC name is 7-(2-fluoro-4,5-dimethoxyphenyl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine.

Molecular Properties

Compound Name7-(2-fluoro-4,5-dimethoxyphenyl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine
PubChem CID19959701
Molecular FormulaC15H16FNO2S
Molecular Weight293.36 g/mol
Exact Mass293.09
IUPAC Name7-(2-fluoro-4,5-dimethoxyphenyl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine
SMILESCOc1cc(F)c(C2NCCc3ccsc32)cc1OC
InChIInChI=1S/C15H16FNO2S/c1-18-12-7-10(11(16)8-13(12)19-2)14-15-9(3-5-17-14)4-6-20-15/h4,6-8,14,17H,3,5H2,1-2H3
InChIKeyDTNZRJPICAGEIT-UHFFFAOYSA-N
XLogP3.14
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.36
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 7-(2-fluoro-4,5-dimethoxyphenyl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine with MolForge

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Related Compounds

3-fluoro-4-(4,5,6,7-tetrahydrothieno[2,3-c]pyridin-7-yl)phenol
CID 67721864
7-(2,3-difluorophenyl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine
CID 54276140
7-ethoxy-6-methoxy-1-(3-methylthiophen-2-yl)-1,2,3,4-tetrahydroisoquinoline
CID 3395962
7-[(2-bromo-4,5-dimethoxyphenyl)methyl]-4,5,6,7-tetrahydrothieno[2,3-c]pyridine
CID 123330032
1-(5-bromo-2-methoxyphenyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline
CID 3969108
(1R)-6,7-dimethoxy-1-pyridin-4-yl-1,2,3,4-tetrahydroisoquinoline
CID 745498
1-(5-ethyl-2-methoxyphenyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline
CID 3938747
6,7-dimethoxy-1-(2-methoxy-5-phenylphenyl)-1,2,3,4-tetrahydroisoquinoline
CID 3933411
6,7-diethoxy-1-(3-fluoro-4-methoxyphenyl)-1,2,3,4-tetrahydroisoquinoline
CID 4530162
(1R)-1-(furan-3-yl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline
CID 96980269
methyl (7R)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-7-carboxylate
CID 124584496
1-chloro-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinoline
CID 141053533

Frequently Asked Questions

What is the IUPAC name of 7-(2-fluoro-4,5-dimethoxyphenyl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine?
The IUPAC name of 7-(2-fluoro-4,5-dimethoxyphenyl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine (CID 19959701) is 7-(2-fluoro-4,5-dimethoxyphenyl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine.
What is the SMILES notation for 7-(2-fluoro-4,5-dimethoxyphenyl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine?
The canonical SMILES for 7-(2-fluoro-4,5-dimethoxyphenyl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine is COc1cc(F)c(C2NCCc3ccsc32)cc1OC.
What is the InChIKey of 7-(2-fluoro-4,5-dimethoxyphenyl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine?
The InChIKey is DTNZRJPICAGEIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FNO2S/c1-18-12-7-10(11(16)8-13(12)19-2)14-15-9(3-5-17-14)4-6-20-15/h4,6-8,14,17H,3,5H2,1-2H3.
What are the key properties of 7-(2-fluoro-4,5-dimethoxyphenyl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine?
7-(2-fluoro-4,5-dimethoxyphenyl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine has a molecular weight of 293.36 g/mol, XLogP of 3.14, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(2-fluoro-4,5-dimethoxyphenyl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine is sourced from PubChem (CID 19959701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).