7-methoxy-2-(4-methoxyphenyl)-1,2,3,4-tetrahydroquinoline

C17H19NO2 — CID 77142132

IUPAC7-methoxy-2-(4-methoxyphenyl)-1,2,3,4-tetrahydroquinoline
SMILESCOc1ccc(C2CCc3ccc(OC)cc3N2)cc1
InChIInChI=1S/C17H19NO2/c1-19-14-7-3-12(4-8-14)16-10-6-13-5-9-15(20-2)11-17(13)18-16/h3-5,7-9,11,16,18H,6,10H2,1-2H3
InChIKeyMDSNXFJIRXESQV-UHFFFAOYSA-N
MW269.34 g/mol
LogP3.80
Rot. Bonds3

About 7-methoxy-2-(4-methoxyphenyl)-1,2,3,4-tetrahydroquinoline

7-methoxy-2-(4-methoxyphenyl)-1,2,3,4-tetrahydroquinoline (PubChem CID 77142132) has the molecular formula C17H19NO2 and a molecular weight of 269.34 g/mol. Its IUPAC name is 7-methoxy-2-(4-methoxyphenyl)-1,2,3,4-tetrahydroquinoline.

Molecular Properties

Compound Name7-methoxy-2-(4-methoxyphenyl)-1,2,3,4-tetrahydroquinoline
PubChem CID77142132
Molecular FormulaC17H19NO2
Molecular Weight269.34 g/mol
Exact Mass269.14
IUPAC Name7-methoxy-2-(4-methoxyphenyl)-1,2,3,4-tetrahydroquinoline
SMILESCOc1ccc(C2CCc3ccc(OC)cc3N2)cc1
InChIInChI=1S/C17H19NO2/c1-19-14-7-3-12(4-8-14)16-10-6-13-5-9-15(20-2)11-17(13)18-16/h3-5,7-9,11,16,18H,6,10H2,1-2H3
InChIKeyMDSNXFJIRXESQV-UHFFFAOYSA-N
XLogP3.80
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.34
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

7-bromo-2-(4-methoxyphenyl)-6-methyl-1,2,3,4-tetrahydroquinoline
CID 132590268
(2S)-2-(4-methoxyphenyl)-6-(trifluoromethyl)-1,2,3,4-tetrahydroquinoline
CID 102598226
[(2R)-7-methoxy-1,2,3,4-tetrahydroquinolin-2-yl]methanol
CID 130625960
7-methoxy-1,2,3,4-tetrahydroquinoline-2-carboxylic acid
CID 84620843
(2S)-2-naphthalen-2-yl-1,2,3,4-tetrahydroquinoline
CID 102250958
4-(4-methoxyphenyl)-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine
CID 16740807
(2S)-2-(4-methoxyphenyl)azetidine
CID 55278634
(2S)-2-phenyl-1,2,3,4-tetrahydrobenzo[g]quinoline
CID 101474621
(2S)-2-(4-methoxyphenyl)-6-methyl-1,2,3,4-tetrahydropyridine-5-carbonitrile
CID 102473074
4-(4-methoxyphenyl)-2-methyl-2,3,4,5-tetrahydro-1H-1,5-benzodiazepine
CID 577333
(2S,3R)-3-cyclopropyl-3-[2-[4-(2-fluoro-5-methoxyphenyl)phenyl]-1,2,3,4-tetrahydroquinolin-7-yl]-2-methylpropanoate
CID 155818457
cyclopropane;methyl 3-[2-[4-(2-fluoro-5-methoxyphenyl)phenyl]-1,2,3,4-tetrahydroquinolin-7-yl]-2-methylpropanoate
CID 145377850

Frequently Asked Questions

What is the IUPAC name of 7-methoxy-2-(4-methoxyphenyl)-1,2,3,4-tetrahydroquinoline?
The IUPAC name of 7-methoxy-2-(4-methoxyphenyl)-1,2,3,4-tetrahydroquinoline (CID 77142132) is 7-methoxy-2-(4-methoxyphenyl)-1,2,3,4-tetrahydroquinoline.
What is the SMILES notation for 7-methoxy-2-(4-methoxyphenyl)-1,2,3,4-tetrahydroquinoline?
The canonical SMILES for 7-methoxy-2-(4-methoxyphenyl)-1,2,3,4-tetrahydroquinoline is COc1ccc(C2CCc3ccc(OC)cc3N2)cc1.
What is the InChIKey of 7-methoxy-2-(4-methoxyphenyl)-1,2,3,4-tetrahydroquinoline?
The InChIKey is MDSNXFJIRXESQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO2/c1-19-14-7-3-12(4-8-14)16-10-6-13-5-9-15(20-2)11-17(13)18-16/h3-5,7-9,11,16,18H,6,10H2,1-2H3.
What are the key properties of 7-methoxy-2-(4-methoxyphenyl)-1,2,3,4-tetrahydroquinoline?
7-methoxy-2-(4-methoxyphenyl)-1,2,3,4-tetrahydroquinoline has a molecular weight of 269.34 g/mol, XLogP of 3.80, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-2-(4-methoxyphenyl)-1,2,3,4-tetrahydroquinoline is sourced from PubChem (CID 77142132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).