N-[[4-(2-methoxyphenyl)phenyl]methyl]-5,6,7,8-tetrahydroquinolin-8-amine

C23H24N2O — CID 142661060

IUPACN-[[4-(2-methoxyphenyl)phenyl]methyl]-5,6,7,8-tetrahydroquinolin-8-amine
SMILESCOc1ccccc1-c1ccc(CNC2CCCc3cccnc32)cc1
InChIInChI=1S/C23H24N2O/c1-26-22-10-3-2-8-20(22)18-13-11-17(12-14-18)16-25-21-9-4-6-19-7-5-15-24-23(19)21/h2-3,5,7-8,10-15,21,25H,4,6,9,16H2,1H3
InChIKeyZPGDCTNWWQQRHC-UHFFFAOYSA-N
MW344.46 g/mol
LogP4.92
Rot. Bonds5

About N-[[4-(2-methoxyphenyl)phenyl]methyl]-5,6,7,8-tetrahydroquinolin-8-amine

N-[[4-(2-methoxyphenyl)phenyl]methyl]-5,6,7,8-tetrahydroquinolin-8-amine (PubChem CID 142661060) has the molecular formula C23H24N2O and a molecular weight of 344.46 g/mol. Its IUPAC name is N-[[4-(2-methoxyphenyl)phenyl]methyl]-5,6,7,8-tetrahydroquinolin-8-amine.

Molecular Properties

Compound NameN-[[4-(2-methoxyphenyl)phenyl]methyl]-5,6,7,8-tetrahydroquinolin-8-amine
PubChem CID142661060
Molecular FormulaC23H24N2O
Molecular Weight344.46 g/mol
Exact Mass344.19
IUPAC NameN-[[4-(2-methoxyphenyl)phenyl]methyl]-5,6,7,8-tetrahydroquinolin-8-amine
SMILESCOc1ccccc1-c1ccc(CNC2CCCc3cccnc32)cc1
InChIInChI=1S/C23H24N2O/c1-26-22-10-3-2-8-20(22)18-13-11-17(12-14-18)16-25-21-9-4-6-19-7-5-15-24-23(19)21/h2-3,5,7-8,10-15,21,25H,4,6,9,16H2,1H3
InChIKeyZPGDCTNWWQQRHC-UHFFFAOYSA-N
XLogP4.92
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.46
LogP ≤ 54.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[[4-(2-methoxyphenyl)phenyl]methyl]-5,6,7,8-tetrahydroquinolin-8-amine?
The IUPAC name of N-[[4-(2-methoxyphenyl)phenyl]methyl]-5,6,7,8-tetrahydroquinolin-8-amine (CID 142661060) is N-[[4-(2-methoxyphenyl)phenyl]methyl]-5,6,7,8-tetrahydroquinolin-8-amine.
What is the SMILES notation for N-[[4-(2-methoxyphenyl)phenyl]methyl]-5,6,7,8-tetrahydroquinolin-8-amine?
The canonical SMILES for N-[[4-(2-methoxyphenyl)phenyl]methyl]-5,6,7,8-tetrahydroquinolin-8-amine is COc1ccccc1-c1ccc(CNC2CCCc3cccnc32)cc1.
What is the InChIKey of N-[[4-(2-methoxyphenyl)phenyl]methyl]-5,6,7,8-tetrahydroquinolin-8-amine?
The InChIKey is ZPGDCTNWWQQRHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O/c1-26-22-10-3-2-8-20(22)18-13-11-17(12-14-18)16-25-21-9-4-6-19-7-5-15-24-23(19)21/h2-3,5,7-8,10-15,21,25H,4,6,9,16H2,1H3.
What are the key properties of N-[[4-(2-methoxyphenyl)phenyl]methyl]-5,6,7,8-tetrahydroquinolin-8-amine?
N-[[4-(2-methoxyphenyl)phenyl]methyl]-5,6,7,8-tetrahydroquinolin-8-amine has a molecular weight of 344.46 g/mol, XLogP of 4.92, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(2-methoxyphenyl)phenyl]methyl]-5,6,7,8-tetrahydroquinolin-8-amine is sourced from PubChem (CID 142661060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).