4-[[8-[[4-(dimethylamino)phenyl]methylideneamino]naphthalen-1-yl]iminomethyl]-N,N-dimethylaniline

C28H28N4 — CID 172965274

IUPAC4-[[8-[[4-(dimethylamino)phenyl]methylideneamino]naphthalen-1-yl]iminomethyl]-N,N-dimethylaniline
SMILESCN(C)c1ccc(/C=N/c2cccc3cccc(/N=C/c4ccc(N(C)C)cc4)c23)cc1
InChIInChI=1S/C28H28N4/c1-31(2)24-15-11-21(12-16-24)19-29-26-9-5-7-23-8-6-10-27(28(23)26)30-20-22-13-17-25(18-14-22)32(3)4/h5-20H,1-4H3/b29-19+,30-20+
InChIKeyZPHHZNVMOONELC-CZYCKNNWSA-N
MW420.56 g/mol
LogP6.47
Rot. Bonds6

About 4-[[8-[[4-(dimethylamino)phenyl]methylideneamino]naphthalen-1-yl]iminomethyl]-N,N-dimethylaniline

4-[[8-[[4-(dimethylamino)phenyl]methylideneamino]naphthalen-1-yl]iminomethyl]-N,N-dimethylaniline (PubChem CID 172965274) has the molecular formula C28H28N4 and a molecular weight of 420.56 g/mol. Its IUPAC name is 4-[[8-[[4-(dimethylamino)phenyl]methylideneamino]naphthalen-1-yl]iminomethyl]-N,N-dimethylaniline.

Molecular Properties

Compound Name4-[[8-[[4-(dimethylamino)phenyl]methylideneamino]naphthalen-1-yl]iminomethyl]-N,N-dimethylaniline
PubChem CID172965274
Molecular FormulaC28H28N4
Molecular Weight420.56 g/mol
Exact Mass420.23
IUPAC Name4-[[8-[[4-(dimethylamino)phenyl]methylideneamino]naphthalen-1-yl]iminomethyl]-N,N-dimethylaniline
SMILESCN(C)c1ccc(/C=N/c2cccc3cccc(/N=C/c4ccc(N(C)C)cc4)c23)cc1
InChIInChI=1S/C28H28N4/c1-31(2)24-15-11-21(12-16-24)19-29-26-9-5-7-23-8-6-10-27(28(23)26)30-20-22-13-17-25(18-14-22)32(3)4/h5-20H,1-4H3/b29-19+,30-20+
InChIKeyZPHHZNVMOONELC-CZYCKNNWSA-N
XLogP6.47
TPSA31.20 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500420.56
LogP ≤ 56.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 4-[[8-[[4-(dimethylamino)phenyl]methylideneamino]naphthalen-1-yl]iminomethyl]-N,N-dimethylaniline 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-naphthalen-1-yl-1-[4-(naphthalen-1-yliminomethyl)phenyl]methanimine
CID 3811018
[2-[[4-(dimethylamino)phenyl]methylideneamino]phenyl] N,N-dimethylsulfamate
CID 124926749
1-[3-[[4-(dimethylamino)phenyl]methylideneamino]phenyl]ethanone
CID 831103
4-[(4-methoxyphenyl)methylideneamino]-N,N-dimethylaniline
CID 3748752
N-[[4-(dimethylamino)phenyl]methylideneamino]naphthalen-1-amine
CID 50885946
4-[(4,5-dimethyl-1,3-thiazol-2-yl)iminomethyl]-N,N-dimethylaniline
CID 3299411
CID 102273448
CID 102273448
N-[[4-(dimethylamino)phenyl]methylideneamino]naphthalen-2-amine
CID 70584569
N,N-dimethyl-4-[(2,3,5,6-tetrafluoro-4-iodophenyl)iminomethyl]aniline
CID 139203663
N-[(Z)-[4-(dimethylamino)phenyl]methylideneamino]benzo[cd]indol-2-amine
CID 6085383
N-[8-(benzylideneamino)naphthalen-1-yl]-1-cyclohepta-1,4,6-trien-1-ylmethanimine
CID 143992225
4-[2-[4-(dimethylamino)phenyl]acenaphthylen-1-yl]-N,N-dimethylaniline
CID 102433569

Frequently Asked Questions

What is the IUPAC name of 4-[[8-[[4-(dimethylamino)phenyl]methylideneamino]naphthalen-1-yl]iminomethyl]-N,N-dimethylaniline?
The IUPAC name of 4-[[8-[[4-(dimethylamino)phenyl]methylideneamino]naphthalen-1-yl]iminomethyl]-N,N-dimethylaniline (CID 172965274) is 4-[[8-[[4-(dimethylamino)phenyl]methylideneamino]naphthalen-1-yl]iminomethyl]-N,N-dimethylaniline.
What is the SMILES notation for 4-[[8-[[4-(dimethylamino)phenyl]methylideneamino]naphthalen-1-yl]iminomethyl]-N,N-dimethylaniline?
The canonical SMILES for 4-[[8-[[4-(dimethylamino)phenyl]methylideneamino]naphthalen-1-yl]iminomethyl]-N,N-dimethylaniline is CN(C)c1ccc(/C=N/c2cccc3cccc(/N=C/c4ccc(N(C)C)cc4)c23)cc1.
What is the InChIKey of 4-[[8-[[4-(dimethylamino)phenyl]methylideneamino]naphthalen-1-yl]iminomethyl]-N,N-dimethylaniline?
The InChIKey is ZPHHZNVMOONELC-CZYCKNNWSA-N. The full InChI is InChI=1S/C28H28N4/c1-31(2)24-15-11-21(12-16-24)19-29-26-9-5-7-23-8-6-10-27(28(23)26)30-20-22-13-17-25(18-14-22)32(3)4/h5-20H,1-4H3/b29-19+,30-20+.
What are the key properties of 4-[[8-[[4-(dimethylamino)phenyl]methylideneamino]naphthalen-1-yl]iminomethyl]-N,N-dimethylaniline?
4-[[8-[[4-(dimethylamino)phenyl]methylideneamino]naphthalen-1-yl]iminomethyl]-N,N-dimethylaniline has a molecular weight of 420.56 g/mol, XLogP of 6.47, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[8-[[4-(dimethylamino)phenyl]methylideneamino]naphthalen-1-yl]iminomethyl]-N,N-dimethylaniline is sourced from PubChem (CID 172965274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).