2-(2,6-diethylphenyl)-N-ethyl-4-methoxy-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-5,6,7,8-tetrahydroquinolin-5-amine

C32H40N2O — CID 25192198

IUPAC2-(2,6-diethylphenyl)-N-ethyl-4-methoxy-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-5,6,7,8-tetrahydroquinolin-5-amine
SMILESCCc1cccc(CC)c1-c1cc(OC)c2c(n1)CCCC2N(CC)c1cccc2c1CCCC2
InChIInChI=1S/C32H40N2O/c1-5-22-14-10-15-23(6-2)31(22)27-21-30(35-4)32-26(33-27)18-12-20-29(32)34(7-3)28-19-11-16-24-13-8-9-17-25(24)28/h10-11,14-16,19,21,29H,5-9,12-13,17-18,20H2,1-4H3
InChIKeyMYJZNRQXRONPBE-UHFFFAOYSA-N
MW468.69 g/mol
LogP7.66
Rot. Bonds7

About 2-(2,6-diethylphenyl)-N-ethyl-4-methoxy-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-5,6,7,8-tetrahydroquinolin-5-amine

2-(2,6-diethylphenyl)-N-ethyl-4-methoxy-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-5,6,7,8-tetrahydroquinolin-5-amine (PubChem CID 25192198) has the molecular formula C32H40N2O and a molecular weight of 468.69 g/mol. Its IUPAC name is 2-(2,6-diethylphenyl)-N-ethyl-4-methoxy-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-5,6,7,8-tetrahydroquinolin-5-amine.

Molecular Properties

Compound Name2-(2,6-diethylphenyl)-N-ethyl-4-methoxy-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-5,6,7,8-tetrahydroquinolin-5-amine
PubChem CID25192198
Molecular FormulaC32H40N2O
Molecular Weight468.69 g/mol
Exact Mass468.31
IUPAC Name2-(2,6-diethylphenyl)-N-ethyl-4-methoxy-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-5,6,7,8-tetrahydroquinolin-5-amine
SMILESCCc1cccc(CC)c1-c1cc(OC)c2c(n1)CCCC2N(CC)c1cccc2c1CCCC2
InChIInChI=1S/C32H40N2O/c1-5-22-14-10-15-23(6-2)31(22)27-21-30(35-4)32-26(33-27)18-12-20-29(32)34(7-3)28-19-11-16-24-13-8-9-17-25(24)28/h10-11,14-16,19,21,29H,5-9,12-13,17-18,20H2,1-4H3
InChIKeyMYJZNRQXRONPBE-UHFFFAOYSA-N
XLogP7.66
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500468.69
LogP ≤ 57.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-(2,6-diethylphenyl)-N-ethyl-4-methoxy-N-(5,6,7,8-tetrahydronaphthalen-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

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-diethylphenyl)-N-ethyl-4-methoxy-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-5,6,7,8-tetrahydroquinolin-5-amine?
The IUPAC name of 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) is 2-(2,6-diethylphenyl)-N-ethyl-4-methoxy-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-5,6,7,8-tetrahydroquinolin-5-amine.
What is the SMILES notation for 2-(2,6-diethylphenyl)-N-ethyl-4-methoxy-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-5,6,7,8-tetrahydroquinolin-5-amine?
The canonical SMILES for 2-(2,6-diethylphenyl)-N-ethyl-4-methoxy-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-5,6,7,8-tetrahydroquinolin-5-amine is CCc1cccc(CC)c1-c1cc(OC)c2c(n1)CCCC2N(CC)c1cccc2c1CCCC2.
What is the InChIKey of 2-(2,6-diethylphenyl)-N-ethyl-4-methoxy-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-5,6,7,8-tetrahydroquinolin-5-amine?
The InChIKey is MYJZNRQXRONPBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H40N2O/c1-5-22-14-10-15-23(6-2)31(22)27-21-30(35-4)32-26(33-27)18-12-20-29(32)34(7-3)28-19-11-16-24-13-8-9-17-25(24)28/h10-11,14-16,19,21,29H,5-9,12-13,17-18,20H2,1-4H3.
What are the key properties of 2-(2,6-diethylphenyl)-N-ethyl-4-methoxy-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-5,6,7,8-tetrahydroquinolin-5-amine?
2-(2,6-diethylphenyl)-N-ethyl-4-methoxy-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-5,6,7,8-tetrahydroquinolin-5-amine has a molecular weight of 468.69 g/mol, XLogP of 7.66, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-diethylphenyl)-N-ethyl-4-methoxy-N-(5,6,7,8-tetrahydronaphthalen-1-yl)-5,6,7,8-tetrahydroquinolin-5-amine is sourced from PubChem (CID 25192198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).