8-methoxy-4-phenyl-1,2,3,4-tetrahydroquinoline

C16H17NO — CID 54763699

IUPAC8-methoxy-4-phenyl-1,2,3,4-tetrahydroquinoline
SMILESCOc1cccc2c1NCCC2c1ccccc1
InChIInChI=1S/C16H17NO/c1-18-15-9-5-8-14-13(10-11-17-16(14)15)12-6-3-2-4-7-12/h2-9,13,17H,10-11H2,1H3
InChIKeyCFBGAHXTUUSDPG-UHFFFAOYSA-N
MW239.32 g/mol
LogP3.64
Rot. Bonds2

About 8-methoxy-4-phenyl-1,2,3,4-tetrahydroquinoline

8-methoxy-4-phenyl-1,2,3,4-tetrahydroquinoline (PubChem CID 54763699) has the molecular formula C16H17NO and a molecular weight of 239.32 g/mol. Its IUPAC name is 8-methoxy-4-phenyl-1,2,3,4-tetrahydroquinoline.

Molecular Properties

Compound Name8-methoxy-4-phenyl-1,2,3,4-tetrahydroquinoline
PubChem CID54763699
Molecular FormulaC16H17NO
Molecular Weight239.32 g/mol
Exact Mass239.13
IUPAC Name8-methoxy-4-phenyl-1,2,3,4-tetrahydroquinoline
SMILESCOc1cccc2c1NCCC2c1ccccc1
InChIInChI=1S/C16H17NO/c1-18-15-9-5-8-14-13(10-11-17-16(14)15)12-6-3-2-4-7-12/h2-9,13,17H,10-11H2,1H3
InChIKeyCFBGAHXTUUSDPG-UHFFFAOYSA-N
XLogP3.64
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

8-methoxy-4-(oxolan-3-yl)-1,2,3,4-tetrahydroquinoline
CID 105493234
(4S)-4-(2-methoxyphenyl)-5-phenyl-1,2,3,4-tetrahydroazepin-7-one
CID 124565893
4-(2-methoxyphenyl)piperidine
CID 544738
6-methoxy-4-phenyl-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline
CID 2846871
1-cyclopropyl-2-methoxybenzene;ethane
CID 144769798
(2R)-2-(2-methoxyphenyl)azetidine
CID 92670019
2-methoxy-7-phenylbicyclo[4.1.0]hepta-1(6),2,4-triene
CID 174806926
8-methoxy-4-phenyl-3,4-dihydro-1H-naphthalen-2-one
CID 56926900
3-(difluoromethyl)-7-methoxy-2,3-dihydro-1H-indole
CID 84668692
(7S,11bR)-8-methoxy-7-phenyl-2,3,4,6,7,11b-hexahydro-1H-pyrazino[2,1-a]isoquinoline
CID 70382095
(7R,11bR)-8-methoxy-7-phenyl-2,3,4,6,7,11b-hexahydro-1H-pyrazino[2,1-a]isoquinoline;dihydrochloride
CID 70407541
(4S)-1-methyl-4-phenyl-4,5,6,7-tetrahydropyrazolo[5,4-b]pyridine
CID 137067861

Frequently Asked Questions

What is the IUPAC name of 8-methoxy-4-phenyl-1,2,3,4-tetrahydroquinoline?
The IUPAC name of 8-methoxy-4-phenyl-1,2,3,4-tetrahydroquinoline (CID 54763699) is 8-methoxy-4-phenyl-1,2,3,4-tetrahydroquinoline.
What is the SMILES notation for 8-methoxy-4-phenyl-1,2,3,4-tetrahydroquinoline?
The canonical SMILES for 8-methoxy-4-phenyl-1,2,3,4-tetrahydroquinoline is COc1cccc2c1NCCC2c1ccccc1.
What is the InChIKey of 8-methoxy-4-phenyl-1,2,3,4-tetrahydroquinoline?
The InChIKey is CFBGAHXTUUSDPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO/c1-18-15-9-5-8-14-13(10-11-17-16(14)15)12-6-3-2-4-7-12/h2-9,13,17H,10-11H2,1H3.
What are the key properties of 8-methoxy-4-phenyl-1,2,3,4-tetrahydroquinoline?
8-methoxy-4-phenyl-1,2,3,4-tetrahydroquinoline has a molecular weight of 239.32 g/mol, XLogP of 3.64, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methoxy-4-phenyl-1,2,3,4-tetrahydroquinoline is sourced from PubChem (CID 54763699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).