N-naphthalen-2-yl-1-(2,2,4,7-tetramethyl-1-propylquinolin-6-yl)methanimine

C27H30N2 — CID 50869022

IUPACN-naphthalen-2-yl-1-(2,2,4,7-tetramethyl-1-propylquinolin-6-yl)methanimine
SMILESCCCN1c2cc(C)c(/C=N/c3ccc4ccccc4c3)cc2C(C)=CC1(C)C
InChIInChI=1S/C27H30N2/c1-6-13-29-26-14-19(2)23(16-25(26)20(3)17-27(29,4)5)18-28-24-12-11-21-9-7-8-10-22(21)15-24/h7-12,14-18H,6,13H2,1-5H3/b28-18+
InChIKeyOBKPRYCERCNCBE-MTDXEUNCSA-N
MW382.55 g/mol
LogP7.31
Rot. Bonds4

About N-naphthalen-2-yl-1-(2,2,4,7-tetramethyl-1-propylquinolin-6-yl)methanimine

N-naphthalen-2-yl-1-(2,2,4,7-tetramethyl-1-propylquinolin-6-yl)methanimine (PubChem CID 50869022) has the molecular formula C27H30N2 and a molecular weight of 382.55 g/mol. Its IUPAC name is N-naphthalen-2-yl-1-(2,2,4,7-tetramethyl-1-propylquinolin-6-yl)methanimine.

Molecular Properties

Compound NameN-naphthalen-2-yl-1-(2,2,4,7-tetramethyl-1-propylquinolin-6-yl)methanimine
PubChem CID50869022
Molecular FormulaC27H30N2
Molecular Weight382.55 g/mol
Exact Mass382.24
IUPAC NameN-naphthalen-2-yl-1-(2,2,4,7-tetramethyl-1-propylquinolin-6-yl)methanimine
SMILESCCCN1c2cc(C)c(/C=N/c3ccc4ccccc4c3)cc2C(C)=CC1(C)C
InChIInChI=1S/C27H30N2/c1-6-13-29-26-14-19(2)23(16-25(26)20(3)17-27(29,4)5)18-28-24-12-11-21-9-7-8-10-22(21)15-24/h7-12,14-18H,6,13H2,1-5H3/b28-18+
InChIKeyOBKPRYCERCNCBE-MTDXEUNCSA-N
XLogP7.31
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500382.55
LogP ≤ 57.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-naphthalen-2-yl-1-(2,2,4,7-tetramethyl-1-propylquinolin-6-yl)methanimine 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

N-phenyl-4-[(2,2,4,7-tetramethyl-1-propylquinolin-6-yl)methylideneamino]aniline
CID 50868952
N-(4-fluoro-3-methylphenyl)-1-(2,2,4,7-tetramethyl-1-propylquinolin-6-yl)methanimine
CID 50868999
N-[4-(4-methylphenoxy)phenyl]-1-(2,2,4,7-tetramethyl-1-propylquinolin-6-yl)methanimine
CID 50868575
N-(4-nitrophenyl)-1-(2,2,4,7-tetramethyl-1-propylquinolin-6-yl)methanimine
CID 50868677
N-(2-fluorophenyl)-1-(2,2,4,7-tetramethyl-1-propylquinolin-6-yl)methanimine
CID 50869014
N-(2-methoxyphenyl)-1-(2,2,4,7-tetramethyl-1-propylquinolin-6-yl)methanimine
CID 50868462
N-[(2,2,4,7-tetramethyl-1-propylquinolin-6-yl)methylidene]hydroxylamine
CID 50868475
1-(7-methoxy-2,2,4-trimethyl-1-propylquinolin-6-yl)-N-phenylmethanimine
CID 50869657
1-(7-methoxy-2,2,4-trimethyl-1-propylquinolin-6-yl)-N-[4-(2-methylphenoxy)phenyl]methanimine
CID 50869837
1-(1-ethyl-2,2,4,7-tetramethylquinolin-6-yl)-N-(2-methylphenyl)methanimine
CID 50866646
1-(1-ethyl-2,2,4,7-tetramethylquinolin-6-yl)-N-(4-fluoro-3-methylphenyl)methanimine
CID 50866938
1-(7-chloro-2,2,4-trimethyl-1-propylquinolin-6-yl)-N-[4-(2-methoxyphenoxy)phenyl]methanimine
CID 50869093

Frequently Asked Questions

What is the IUPAC name of N-naphthalen-2-yl-1-(2,2,4,7-tetramethyl-1-propylquinolin-6-yl)methanimine?
The IUPAC name of N-naphthalen-2-yl-1-(2,2,4,7-tetramethyl-1-propylquinolin-6-yl)methanimine (CID 50869022) is N-naphthalen-2-yl-1-(2,2,4,7-tetramethyl-1-propylquinolin-6-yl)methanimine.
What is the SMILES notation for N-naphthalen-2-yl-1-(2,2,4,7-tetramethyl-1-propylquinolin-6-yl)methanimine?
The canonical SMILES for N-naphthalen-2-yl-1-(2,2,4,7-tetramethyl-1-propylquinolin-6-yl)methanimine is CCCN1c2cc(C)c(/C=N/c3ccc4ccccc4c3)cc2C(C)=CC1(C)C.
What is the InChIKey of N-naphthalen-2-yl-1-(2,2,4,7-tetramethyl-1-propylquinolin-6-yl)methanimine?
The InChIKey is OBKPRYCERCNCBE-MTDXEUNCSA-N. The full InChI is InChI=1S/C27H30N2/c1-6-13-29-26-14-19(2)23(16-25(26)20(3)17-27(29,4)5)18-28-24-12-11-21-9-7-8-10-22(21)15-24/h7-12,14-18H,6,13H2,1-5H3/b28-18+.
What are the key properties of N-naphthalen-2-yl-1-(2,2,4,7-tetramethyl-1-propylquinolin-6-yl)methanimine?
N-naphthalen-2-yl-1-(2,2,4,7-tetramethyl-1-propylquinolin-6-yl)methanimine has a molecular weight of 382.55 g/mol, XLogP of 7.31, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-naphthalen-2-yl-1-(2,2,4,7-tetramethyl-1-propylquinolin-6-yl)methanimine is sourced from PubChem (CID 50869022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).