N-[(E)-(4-fluorophenyl)methylideneamino]-N-methyl-1-naphthalen-1-ylmethanamine

C19H17FN2 — CID 6478463

IUPACN-[(E)-(4-fluorophenyl)methylideneamino]-N-methyl-1-naphthalen-1-ylmethanamine
SMILESCN(Cc1cccc2ccccc12)/N=C/c1ccc(F)cc1
InChIInChI=1S/C19H17FN2/c1-22(21-13-15-9-11-18(20)12-10-15)14-17-7-4-6-16-5-2-3-8-19(16)17/h2-13H,14H2,1H3/b21-13+
InChIKeyDQYHOBKZYOHPSA-FYJGNVAPSA-N
MW292.36 g/mol
LogP4.44
Rot. Bonds4

About N-[(E)-(4-fluorophenyl)methylideneamino]-N-methyl-1-naphthalen-1-ylmethanamine

N-[(E)-(4-fluorophenyl)methylideneamino]-N-methyl-1-naphthalen-1-ylmethanamine (PubChem CID 6478463) has the molecular formula C19H17FN2 and a molecular weight of 292.36 g/mol. Its IUPAC name is N-[(E)-(4-fluorophenyl)methylideneamino]-N-methyl-1-naphthalen-1-ylmethanamine.

Molecular Properties

Compound NameN-[(E)-(4-fluorophenyl)methylideneamino]-N-methyl-1-naphthalen-1-ylmethanamine
PubChem CID6478463
Molecular FormulaC19H17FN2
Molecular Weight292.36 g/mol
Exact Mass292.14
IUPAC NameN-[(E)-(4-fluorophenyl)methylideneamino]-N-methyl-1-naphthalen-1-ylmethanamine
SMILESCN(Cc1cccc2ccccc12)/N=C/c1ccc(F)cc1
InChIInChI=1S/C19H17FN2/c1-22(21-13-15-9-11-18(20)12-10-15)14-17-7-4-6-16-5-2-3-8-19(16)17/h2-13H,14H2,1H3/b21-13+
InChIKeyDQYHOBKZYOHPSA-FYJGNVAPSA-N
XLogP4.44
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.36
LogP ≤ 54.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-[(E)-(4-fluorophenyl)methylideneamino]-N-methyl-1-naphthalen-1-ylmethanamine 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-methyl-1-naphthalen-1-yl-N-[(E)-[4-(2-phenylpropan-2-yl)phenyl]methylideneamino]methanamine
CID 6478470
1-[(4-fluorophenyl)methyl]naphthalene
CID 11118033
1-(1-benzothiophen-7-yl)-N-[(E)-(4-tert-butylphenyl)methylideneamino]-N-methylmethanamine
CID 177445979
N-methanidyl-N-methyl-1-naphthalen-1-ylmethanamine
CID 20723537
N-[(E)-benzylideneamino]-4-fluoro-N-methylaniline
CID 141421369
1-[[(E)-2-(4-fluorophenyl)ethenyl]sulfinylmethyl]naphthalene
CID 11370324
4-N-(benzylideneamino)-1-N,1-N-diethyl-4-N-(2-naphthalen-1-ylethyl)benzene-1,4-diamine
CID 67919479
1-naphthalen-1-yl-N,N-bis(trimethylsilyl)methanamine
CID 11779651
6-fluoro-2-(naphthalen-1-ylmethyl)-1H-benzimidazole
CID 60978250
N-naphthalen-1-yl-1-[4-(naphthalen-1-yliminomethyl)phenyl]methanimine
CID 3811018
4-fluoro-N-methyl-N-(2-naphthalen-1-ylethyl)benzenesulfonamide
CID 154857610
2-[[methyl(naphthalen-1-ylmethyl)amino]methyl]aniline
CID 43458604

Frequently Asked Questions

What is the IUPAC name of N-[(E)-(4-fluorophenyl)methylideneamino]-N-methyl-1-naphthalen-1-ylmethanamine?
The IUPAC name of N-[(E)-(4-fluorophenyl)methylideneamino]-N-methyl-1-naphthalen-1-ylmethanamine (CID 6478463) is N-[(E)-(4-fluorophenyl)methylideneamino]-N-methyl-1-naphthalen-1-ylmethanamine.
What is the SMILES notation for N-[(E)-(4-fluorophenyl)methylideneamino]-N-methyl-1-naphthalen-1-ylmethanamine?
The canonical SMILES for N-[(E)-(4-fluorophenyl)methylideneamino]-N-methyl-1-naphthalen-1-ylmethanamine is CN(Cc1cccc2ccccc12)/N=C/c1ccc(F)cc1.
What is the InChIKey of N-[(E)-(4-fluorophenyl)methylideneamino]-N-methyl-1-naphthalen-1-ylmethanamine?
The InChIKey is DQYHOBKZYOHPSA-FYJGNVAPSA-N. The full InChI is InChI=1S/C19H17FN2/c1-22(21-13-15-9-11-18(20)12-10-15)14-17-7-4-6-16-5-2-3-8-19(16)17/h2-13H,14H2,1H3/b21-13+.
What are the key properties of N-[(E)-(4-fluorophenyl)methylideneamino]-N-methyl-1-naphthalen-1-ylmethanamine?
N-[(E)-(4-fluorophenyl)methylideneamino]-N-methyl-1-naphthalen-1-ylmethanamine has a molecular weight of 292.36 g/mol, XLogP of 4.44, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-(4-fluorophenyl)methylideneamino]-N-methyl-1-naphthalen-1-ylmethanamine is sourced from PubChem (CID 6478463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).