N-(4-fluoro-3-methylphenyl)-1-(2,2,4,7-tetramethyl-1-propylquinolin-6-yl)methanimine

C24H29FN2 — CID 50868999

IUPACN-(4-fluoro-3-methylphenyl)-1-(2,2,4,7-tetramethyl-1-propylquinolin-6-yl)methanimine
SMILESCCCN1c2cc(C)c(/C=N/c3ccc(F)c(C)c3)cc2C(C)=CC1(C)C
InChIInChI=1S/C24H29FN2/c1-7-10-27-23-12-16(2)19(13-21(23)18(4)14-24(27,5)6)15-26-20-8-9-22(25)17(3)11-20/h8-9,11-15H,7,10H2,1-6H3/b26-15+
InChIKeyGUHXBKCPYBWRPC-CVKSISIWSA-N
MW364.51 g/mol
LogP6.61
Rot. Bonds4

About N-(4-fluoro-3-methylphenyl)-1-(2,2,4,7-tetramethyl-1-propylquinolin-6-yl)methanimine

N-(4-fluoro-3-methylphenyl)-1-(2,2,4,7-tetramethyl-1-propylquinolin-6-yl)methanimine (PubChem CID 50868999) has the molecular formula C24H29FN2 and a molecular weight of 364.51 g/mol. Its IUPAC name is N-(4-fluoro-3-methylphenyl)-1-(2,2,4,7-tetramethyl-1-propylquinolin-6-yl)methanimine.

Molecular Properties

Compound NameN-(4-fluoro-3-methylphenyl)-1-(2,2,4,7-tetramethyl-1-propylquinolin-6-yl)methanimine
PubChem CID50868999
Molecular FormulaC24H29FN2
Molecular Weight364.51 g/mol
Exact Mass364.23
IUPAC NameN-(4-fluoro-3-methylphenyl)-1-(2,2,4,7-tetramethyl-1-propylquinolin-6-yl)methanimine
SMILESCCCN1c2cc(C)c(/C=N/c3ccc(F)c(C)c3)cc2C(C)=CC1(C)C
InChIInChI=1S/C24H29FN2/c1-7-10-27-23-12-16(2)19(13-21(23)18(4)14-24(27,5)6)15-26-20-8-9-22(25)17(3)11-20/h8-9,11-15H,7,10H2,1-6H3/b26-15+
InChIKeyGUHXBKCPYBWRPC-CVKSISIWSA-N
XLogP6.61
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500364.51
LogP ≤ 56.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1-(1-ethyl-2,2,4,7-tetramethylquinolin-6-yl)-N-(4-fluoro-3-methylphenyl)methanimine
CID 50866938
N-naphthalen-2-yl-1-(2,2,4,7-tetramethyl-1-propylquinolin-6-yl)methanimine
CID 50869022
N-(2-fluorophenyl)-1-(2,2,4,7-tetramethyl-1-propylquinolin-6-yl)methanimine
CID 50869014
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-(4-fluoro-3-methylphenyl)-1-(7-fluoro-1,2,2,4-tetramethylquinolin-6-yl)methanimine
CID 50865604
N-(3-chlorophenyl)-1-(7-fluoro-2,2,4-trimethyl-1-propylquinolin-6-yl)methanimine
CID 50869612
N-(4-chlorophenyl)-1-(1-ethyl-2,2,4,7-tetramethylquinolin-6-yl)methanimine
CID 50866985
1-(7-chloro-1,2,2,4-tetramethylquinolin-6-yl)-N-(4-fluoro-3-methylphenyl)methanimine
CID 50865436
N-[(2,2,4,7-tetramethyl-1-propylquinolin-6-yl)methylidene]hydroxylamine
CID 50868475
N-(2-methoxyphenyl)-1-(2,2,4,7-tetramethyl-1-propylquinolin-6-yl)methanimine
CID 50868462
N-(2-fluorophenyl)-1-(7-fluoro-2,2,4-trimethyl-1-propylquinolin-6-yl)methanimine
CID 50869663

Frequently Asked Questions

What is the IUPAC name of N-(4-fluoro-3-methylphenyl)-1-(2,2,4,7-tetramethyl-1-propylquinolin-6-yl)methanimine?
The IUPAC name of N-(4-fluoro-3-methylphenyl)-1-(2,2,4,7-tetramethyl-1-propylquinolin-6-yl)methanimine (CID 50868999) is N-(4-fluoro-3-methylphenyl)-1-(2,2,4,7-tetramethyl-1-propylquinolin-6-yl)methanimine.
What is the SMILES notation for N-(4-fluoro-3-methylphenyl)-1-(2,2,4,7-tetramethyl-1-propylquinolin-6-yl)methanimine?
The canonical SMILES for N-(4-fluoro-3-methylphenyl)-1-(2,2,4,7-tetramethyl-1-propylquinolin-6-yl)methanimine is CCCN1c2cc(C)c(/C=N/c3ccc(F)c(C)c3)cc2C(C)=CC1(C)C.
What is the InChIKey of N-(4-fluoro-3-methylphenyl)-1-(2,2,4,7-tetramethyl-1-propylquinolin-6-yl)methanimine?
The InChIKey is GUHXBKCPYBWRPC-CVKSISIWSA-N. The full InChI is InChI=1S/C24H29FN2/c1-7-10-27-23-12-16(2)19(13-21(23)18(4)14-24(27,5)6)15-26-20-8-9-22(25)17(3)11-20/h8-9,11-15H,7,10H2,1-6H3/b26-15+.
What are the key properties of N-(4-fluoro-3-methylphenyl)-1-(2,2,4,7-tetramethyl-1-propylquinolin-6-yl)methanimine?
N-(4-fluoro-3-methylphenyl)-1-(2,2,4,7-tetramethyl-1-propylquinolin-6-yl)methanimine has a molecular weight of 364.51 g/mol, XLogP of 6.61, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluoro-3-methylphenyl)-1-(2,2,4,7-tetramethyl-1-propylquinolin-6-yl)methanimine is sourced from PubChem (CID 50868999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).