N-(2-ethoxyphenyl)-1-(1-ethyl-2,2,4,7-tetramethyl-3,4-dihydroquinolin-6-yl)methanimine

C24H32N2O — CID 50860596

IUPACN-(2-ethoxyphenyl)-1-(1-ethyl-2,2,4,7-tetramethyl-3,4-dihydroquinolin-6-yl)methanimine
SMILESCCOc1ccccc1/N=C/c1cc2c(cc1C)N(CC)C(C)(C)CC2C
InChIInChI=1S/C24H32N2O/c1-7-26-22-13-17(3)19(14-20(22)18(4)15-24(26,5)6)16-25-21-11-9-10-12-23(21)27-8-2/h9-14,16,18H,7-8,15H2,1-6H3/b25-16+
InChIKeyBMHPWOCVPCYDOS-PCLIKHOPSA-N
MW364.53 g/mol
LogP6.26
Rot. Bonds5

About N-(2-ethoxyphenyl)-1-(1-ethyl-2,2,4,7-tetramethyl-3,4-dihydroquinolin-6-yl)methanimine

N-(2-ethoxyphenyl)-1-(1-ethyl-2,2,4,7-tetramethyl-3,4-dihydroquinolin-6-yl)methanimine (PubChem CID 50860596) has the molecular formula C24H32N2O and a molecular weight of 364.53 g/mol. Its IUPAC name is N-(2-ethoxyphenyl)-1-(1-ethyl-2,2,4,7-tetramethyl-3,4-dihydroquinolin-6-yl)methanimine.

Molecular Properties

Compound NameN-(2-ethoxyphenyl)-1-(1-ethyl-2,2,4,7-tetramethyl-3,4-dihydroquinolin-6-yl)methanimine
PubChem CID50860596
Molecular FormulaC24H32N2O
Molecular Weight364.53 g/mol
Exact Mass364.25
IUPAC NameN-(2-ethoxyphenyl)-1-(1-ethyl-2,2,4,7-tetramethyl-3,4-dihydroquinolin-6-yl)methanimine
SMILESCCOc1ccccc1/N=C/c1cc2c(cc1C)N(CC)C(C)(C)CC2C
InChIInChI=1S/C24H32N2O/c1-7-26-22-13-17(3)19(14-20(22)18(4)15-24(26,5)6)16-25-21-11-9-10-12-23(21)27-8-2/h9-14,16,18H,7-8,15H2,1-6H3/b25-16+
InChIKeyBMHPWOCVPCYDOS-PCLIKHOPSA-N
XLogP6.26
TPSA24.83 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500364.53
LogP ≤ 56.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

1-[(4R)-1-ethyl-2,2,4,7-tetramethyl-3,4-dihydroquinolin-6-yl]-N-phenylmethanimine
CID 124631427
N-(2-methoxyphenyl)-1-(2,2,4,7-tetramethyl-1-propyl-3,4-dihydroquinolin-6-yl)methanimine
CID 50862689
1-[(4S)-1-ethyl-2,2,4,7-tetramethyl-3,4-dihydroquinolin-6-yl]-N-[4-(2-methoxyphenoxy)phenyl]methanimine
CID 99865775
1-(7-chloro-1,2,2,4-tetramethyl-3,4-dihydroquinolin-6-yl)-N-(2-ethoxyphenyl)methanimine
CID 50859098
1-[(4S)-1-ethyl-2,2,4,7-tetramethyl-3,4-dihydroquinolin-6-yl]-N-(4-methylphenyl)methanimine
CID 99865763
1-[(4R)-1-ethyl-2,2,4,7-tetramethyl-3,4-dihydroquinolin-6-yl]-N-(6-methoxy-3-pyridinyl)methanimine
CID 125043341
N-(3-bromophenyl)-1-(1-ethyl-2,2,4,7-tetramethyl-3,4-dihydroquinolin-6-yl)methanimine
CID 50860862
N-(4-tert-butylphenyl)-1-(1-ethyl-2,2,4,7-tetramethyl-3,4-dihydroquinolin-6-yl)methanimine
CID 50860708
N-(2-methoxyphenyl)-1-(2,2,4,7-tetramethyl-1-propan-2-yl-3,4-dihydroquinolin-6-yl)methanimine
CID 132654682
N-(3-chloro-4-methylphenyl)-1-(1-ethyl-2,2,4,7-tetramethyl-3,4-dihydroquinolin-6-yl)methanimine
CID 50860626
1-(1-ethyl-2,2,4,7-tetramethyl-3,4-dihydroquinolin-6-yl)-N-[4-(4-methoxyphenoxy)phenyl]methanimine
CID 50860728
N-(2,5-dimethylphenyl)-1-(1-ethyl-7-methoxy-2,2,4-trimethyl-3,4-dihydroquinolin-6-yl)methanimine
CID 50862167

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyphenyl)-1-(1-ethyl-2,2,4,7-tetramethyl-3,4-dihydroquinolin-6-yl)methanimine?
The IUPAC name of N-(2-ethoxyphenyl)-1-(1-ethyl-2,2,4,7-tetramethyl-3,4-dihydroquinolin-6-yl)methanimine (CID 50860596) is N-(2-ethoxyphenyl)-1-(1-ethyl-2,2,4,7-tetramethyl-3,4-dihydroquinolin-6-yl)methanimine.
What is the SMILES notation for N-(2-ethoxyphenyl)-1-(1-ethyl-2,2,4,7-tetramethyl-3,4-dihydroquinolin-6-yl)methanimine?
The canonical SMILES for N-(2-ethoxyphenyl)-1-(1-ethyl-2,2,4,7-tetramethyl-3,4-dihydroquinolin-6-yl)methanimine is CCOc1ccccc1/N=C/c1cc2c(cc1C)N(CC)C(C)(C)CC2C.
What is the InChIKey of N-(2-ethoxyphenyl)-1-(1-ethyl-2,2,4,7-tetramethyl-3,4-dihydroquinolin-6-yl)methanimine?
The InChIKey is BMHPWOCVPCYDOS-PCLIKHOPSA-N. The full InChI is InChI=1S/C24H32N2O/c1-7-26-22-13-17(3)19(14-20(22)18(4)15-24(26,5)6)16-25-21-11-9-10-12-23(21)27-8-2/h9-14,16,18H,7-8,15H2,1-6H3/b25-16+.
What are the key properties of N-(2-ethoxyphenyl)-1-(1-ethyl-2,2,4,7-tetramethyl-3,4-dihydroquinolin-6-yl)methanimine?
N-(2-ethoxyphenyl)-1-(1-ethyl-2,2,4,7-tetramethyl-3,4-dihydroquinolin-6-yl)methanimine has a molecular weight of 364.53 g/mol, XLogP of 6.26, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyphenyl)-1-(1-ethyl-2,2,4,7-tetramethyl-3,4-dihydroquinolin-6-yl)methanimine is sourced from PubChem (CID 50860596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).