N-(2,4-dibromophenyl)-1-naphthalen-1-ylmethanimine

C17H11Br2N — CID 21210393

IUPACN-(2,4-dibromophenyl)-1-naphthalen-1-ylmethanimine
SMILESBrc1ccc(/N=C/c2cccc3ccccc23)c(Br)c1
InChIInChI=1S/C17H11Br2N/c18-14-8-9-17(16(19)10-14)20-11-13-6-3-5-12-4-1-2-7-15(12)13/h1-11H/b20-11+
InChIKeyITPRLZWCKBHXSI-RGVLZGJSSA-N
MW389.09 g/mol
LogP6.12
Rot. Bonds2

About N-(2,4-dibromophenyl)-1-naphthalen-1-ylmethanimine

N-(2,4-dibromophenyl)-1-naphthalen-1-ylmethanimine (PubChem CID 21210393) has the molecular formula C17H11Br2N and a molecular weight of 389.09 g/mol. Its IUPAC name is N-(2,4-dibromophenyl)-1-naphthalen-1-ylmethanimine.

Molecular Properties

Compound NameN-(2,4-dibromophenyl)-1-naphthalen-1-ylmethanimine
PubChem CID21210393
Molecular FormulaC17H11Br2N
Molecular Weight389.09 g/mol
Exact Mass386.93
IUPAC NameN-(2,4-dibromophenyl)-1-naphthalen-1-ylmethanimine
SMILESBrc1ccc(/N=C/c2cccc3ccccc23)c(Br)c1
InChIInChI=1S/C17H11Br2N/c18-14-8-9-17(16(19)10-14)20-11-13-6-3-5-12-4-1-2-7-15(12)13/h1-11H/b20-11+
InChIKeyITPRLZWCKBHXSI-RGVLZGJSSA-N
XLogP6.12
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500389.09
LogP ≤ 56.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-[2-methyl-4-[3-methyl-4-(naphthalen-1-ylmethylideneamino)phenyl]phenyl]-1-naphthalen-1-ylmethanimine
CID 2195225
N-(2,4-dimethylphenyl)-1-naphthalen-1-ylmethanimine
CID 1381168
N-(4-bromo-3-methylphenyl)-1-naphthalen-1-ylmethanimine
CID 2346219
N-(4-bromo-3-chlorophenyl)-1-naphthalen-1-ylmethanimine
CID 4580179
1-naphthalen-1-yl-N-phenylmethanimine
CID 615538
(E)-N-[4,6-bis[(E)-naphthalen-1-ylmethylideneamino]-1,3,5-triazin-2-yl]-1-naphthalen-1-ylmethanimine
CID 22086741
N-(2,4-dibromophenyl)-1-(3-fluorophenyl)methanimine
CID 23329288
4-methyl-2-(naphthalen-1-ylmethylideneamino)phenol
CID 832580
4-benzyl-2-bromo-6-(naphthalen-1-yliminomethyl)phenol
CID 3987318
copper;bis(2,4-dibromo-6-(naphthalen-1-yliminomethyl)phenolate);1,10-phenanthroline
CID 139073230
1-[(5-bromo-2-hydroxyphenyl)iminomethyl]naphthalen-2-ol
CID 794050
N-naphthalen-1-yl-1-[4-(naphthalen-1-yliminomethyl)phenyl]methanimine
CID 3811018

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dibromophenyl)-1-naphthalen-1-ylmethanimine?
The IUPAC name of N-(2,4-dibromophenyl)-1-naphthalen-1-ylmethanimine (CID 21210393) is N-(2,4-dibromophenyl)-1-naphthalen-1-ylmethanimine.
What is the SMILES notation for N-(2,4-dibromophenyl)-1-naphthalen-1-ylmethanimine?
The canonical SMILES for N-(2,4-dibromophenyl)-1-naphthalen-1-ylmethanimine is Brc1ccc(/N=C/c2cccc3ccccc23)c(Br)c1.
What is the InChIKey of N-(2,4-dibromophenyl)-1-naphthalen-1-ylmethanimine?
The InChIKey is ITPRLZWCKBHXSI-RGVLZGJSSA-N. The full InChI is InChI=1S/C17H11Br2N/c18-14-8-9-17(16(19)10-14)20-11-13-6-3-5-12-4-1-2-7-15(12)13/h1-11H/b20-11+.
What are the key properties of N-(2,4-dibromophenyl)-1-naphthalen-1-ylmethanimine?
N-(2,4-dibromophenyl)-1-naphthalen-1-ylmethanimine has a molecular weight of 389.09 g/mol, XLogP of 6.12, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dibromophenyl)-1-naphthalen-1-ylmethanimine is sourced from PubChem (CID 21210393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).