2-(2-chloro-6-methoxyphenyl)-N-ethyl-4-methoxy-N-naphthalen-1-yl-5,6,7,8-tetrahydroquinolin-5-amine

C29H29ClN2O2 — CID 25191898

IUPAC2-(2-chloro-6-methoxyphenyl)-N-ethyl-4-methoxy-N-naphthalen-1-yl-5,6,7,8-tetrahydroquinolin-5-amine
SMILESCCN(c1cccc2ccccc12)C1CCCc2nc(-c3c(Cl)cccc3OC)cc(OC)c21
InChIInChI=1S/C29H29ClN2O2/c1-4-32(24-15-7-11-19-10-5-6-12-20(19)24)25-16-9-14-22-29(25)27(34-3)18-23(31-22)28-21(30)13-8-17-26(28)33-2/h5-8,10-13,15,17-18,25H,4,9,14,16H2,1-3H3
InChIKeyYHJWLTLIFNXJBY-UHFFFAOYSA-N
MW473.02 g/mol
LogP7.48
Rot. Bonds6

About 2-(2-chloro-6-methoxyphenyl)-N-ethyl-4-methoxy-N-naphthalen-1-yl-5,6,7,8-tetrahydroquinolin-5-amine

2-(2-chloro-6-methoxyphenyl)-N-ethyl-4-methoxy-N-naphthalen-1-yl-5,6,7,8-tetrahydroquinolin-5-amine (PubChem CID 25191898) has the molecular formula C29H29ClN2O2 and a molecular weight of 473.02 g/mol. Its IUPAC name is 2-(2-chloro-6-methoxyphenyl)-N-ethyl-4-methoxy-N-naphthalen-1-yl-5,6,7,8-tetrahydroquinolin-5-amine.

Molecular Properties

Compound Name2-(2-chloro-6-methoxyphenyl)-N-ethyl-4-methoxy-N-naphthalen-1-yl-5,6,7,8-tetrahydroquinolin-5-amine
PubChem CID25191898
Molecular FormulaC29H29ClN2O2
Molecular Weight473.02 g/mol
Exact Mass472.19
IUPAC Name2-(2-chloro-6-methoxyphenyl)-N-ethyl-4-methoxy-N-naphthalen-1-yl-5,6,7,8-tetrahydroquinolin-5-amine
SMILESCCN(c1cccc2ccccc12)C1CCCc2nc(-c3c(Cl)cccc3OC)cc(OC)c21
InChIInChI=1S/C29H29ClN2O2/c1-4-32(24-15-7-11-19-10-5-6-12-20(19)24)25-16-9-14-22-29(25)27(34-3)18-23(31-22)28-21(30)13-8-17-26(28)33-2/h5-8,10-13,15,17-18,25H,4,9,14,16H2,1-3H3
InChIKeyYHJWLTLIFNXJBY-UHFFFAOYSA-N
XLogP7.48
TPSA34.59 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500473.02
LogP ≤ 57.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-(2-chloro-6-methoxyphenyl)-N-ethyl-4-methoxy-N-naphthalen-1-yl-5,6,7,8-tetrahydroquinolin-5-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(+/-)-[2-(2,6-Diethyl-phenyl)-4-methoxy-5,6,7,8-tetrahydro-quinolin-5-yl]-ethyl-naphthlen-1-yl-amine
CID 25010731
N-ethyl-4-methoxy-N,2-dinaphthalen-1-yl-5,6,7,8-tetrahydroquinolin-5-amine
CID 25191265
2-(2,6-dimethylphenyl)-N-ethyl-4-methoxy-N-naphthalen-1-yl-5,6,7,8-tetrahydroquinolin-5-amine
CID 25191901
(+/-)-[2-(2,6-Diethyl-phenyl)-4-methoxy-5,6,7,8-tetrahydro-quinolin-5-yl]-methyl-naphthlen-1-yl-amine
CID 25192049
N-ethyl-4-methoxy-2-(4-methoxy-2,6-dimethylphenyl)-N-naphthalen-1-yl-5,6,7,8-tetrahydroquinolin-5-amine
CID 25192050
2-(2,6-diethylphenyl)-N-ethyl-4-methoxy-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-5,6,7,8-tetrahydroquinolin-5-amine
CID 25192198
2-(2,6-diethylphenyl)-N-ethyl-N-naphthalen-1-yl-4-phenylmethoxy-5,6,7,8-tetrahydroquinolin-5-amine
CID 25192335
N-ethyl-4-methoxy-2-(2-methylphenyl)-N-naphthalen-1-yl-5,6,7,8-tetrahydroquinolin-5-amine
CID 25192338
2-(2,6-diethylphenyl)-4-methoxy-N-(4-methoxynaphthalen-1-yl)-N-methyl-5,6,7,8-tetrahydroquinolin-5-amine
CID 25192491
N-ethyl-2-(2-ethylphenyl)-4-methoxy-N-naphthalen-1-yl-5,6,7,8-tetrahydroquinolin-5-amine
CID 25192633
N-ethyl-2-(2-fluorophenyl)-4-methoxy-N-naphthalen-1-yl-5,6,7,8-tetrahydroquinolin-5-amine
CID 25191131
2-(2,6-diethylphenyl)-4-methoxy-N-methyl-N-(2-methylnaphthalen-1-yl)-5,6,7,8-tetrahydroquinolin-5-amine
CID 25192897

Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-6-methoxyphenyl)-N-ethyl-4-methoxy-N-naphthalen-1-yl-5,6,7,8-tetrahydroquinolin-5-amine?
The IUPAC name of 2-(2-chloro-6-methoxyphenyl)-N-ethyl-4-methoxy-N-naphthalen-1-yl-5,6,7,8-tetrahydroquinolin-5-amine (CID 25191898) is 2-(2-chloro-6-methoxyphenyl)-N-ethyl-4-methoxy-N-naphthalen-1-yl-5,6,7,8-tetrahydroquinolin-5-amine.
What is the SMILES notation for 2-(2-chloro-6-methoxyphenyl)-N-ethyl-4-methoxy-N-naphthalen-1-yl-5,6,7,8-tetrahydroquinolin-5-amine?
The canonical SMILES for 2-(2-chloro-6-methoxyphenyl)-N-ethyl-4-methoxy-N-naphthalen-1-yl-5,6,7,8-tetrahydroquinolin-5-amine is CCN(c1cccc2ccccc12)C1CCCc2nc(-c3c(Cl)cccc3OC)cc(OC)c21.
What is the InChIKey of 2-(2-chloro-6-methoxyphenyl)-N-ethyl-4-methoxy-N-naphthalen-1-yl-5,6,7,8-tetrahydroquinolin-5-amine?
The InChIKey is YHJWLTLIFNXJBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H29ClN2O2/c1-4-32(24-15-7-11-19-10-5-6-12-20(19)24)25-16-9-14-22-29(25)27(34-3)18-23(31-22)28-21(30)13-8-17-26(28)33-2/h5-8,10-13,15,17-18,25H,4,9,14,16H2,1-3H3.
What are the key properties of 2-(2-chloro-6-methoxyphenyl)-N-ethyl-4-methoxy-N-naphthalen-1-yl-5,6,7,8-tetrahydroquinolin-5-amine?
2-(2-chloro-6-methoxyphenyl)-N-ethyl-4-methoxy-N-naphthalen-1-yl-5,6,7,8-tetrahydroquinolin-5-amine has a molecular weight of 473.02 g/mol, XLogP of 7.48, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloro-6-methoxyphenyl)-N-ethyl-4-methoxy-N-naphthalen-1-yl-5,6,7,8-tetrahydroquinolin-5-amine is sourced from PubChem (CID 25191898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).