(E)-1-(4-bromophenyl)-N-[(E)-(4-bromophenyl)methylideneamino]methanimine

C14H10Br2N2 — CID 6894308

IUPAC(E)-1-(4-bromophenyl)-N-[(E)-(4-bromophenyl)methylideneamino]methanimine
SMILESBrc1ccc(/C=N/N=C/c2ccc(Br)cc2)cc1
InChIInChI=1S/C14H10Br2N2/c15-13-5-1-11(2-6-13)9-17-18-10-12-3-7-14(16)8-4-12/h1-10H/b17-9+,18-10+
InChIKeyLBYGBPAMWPZZRE-BEQMOXJMSA-N
MW366.06 g/mol
LogP4.66
Rot. Bonds3

About (E)-1-(4-bromophenyl)-N-[(E)-(4-bromophenyl)methylideneamino]methanimine

(E)-1-(4-bromophenyl)-N-[(E)-(4-bromophenyl)methylideneamino]methanimine (PubChem CID 6894308) has the molecular formula C14H10Br2N2 and a molecular weight of 366.06 g/mol. Its IUPAC name is (E)-1-(4-bromophenyl)-N-[(E)-(4-bromophenyl)methylideneamino]methanimine.

Molecular Properties

Compound Name(E)-1-(4-bromophenyl)-N-[(E)-(4-bromophenyl)methylideneamino]methanimine
PubChem CID6894308
Molecular FormulaC14H10Br2N2
Molecular Weight366.06 g/mol
Exact Mass363.92
IUPAC Name(E)-1-(4-bromophenyl)-N-[(E)-(4-bromophenyl)methylideneamino]methanimine
SMILESBrc1ccc(/C=N/N=C/c2ccc(Br)cc2)cc1
InChIInChI=1S/C14H10Br2N2/c15-13-5-1-11(2-6-13)9-17-18-10-12-3-7-14(16)8-4-12/h1-10H/b17-9+,18-10+
InChIKeyLBYGBPAMWPZZRE-BEQMOXJMSA-N
XLogP4.66
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.06
LogP ≤ 54.66
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'}

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Frequently Asked Questions

What is the IUPAC name of (E)-1-(4-bromophenyl)-N-[(E)-(4-bromophenyl)methylideneamino]methanimine?
The IUPAC name of (E)-1-(4-bromophenyl)-N-[(E)-(4-bromophenyl)methylideneamino]methanimine (CID 6894308) is (E)-1-(4-bromophenyl)-N-[(E)-(4-bromophenyl)methylideneamino]methanimine.
What is the SMILES notation for (E)-1-(4-bromophenyl)-N-[(E)-(4-bromophenyl)methylideneamino]methanimine?
The canonical SMILES for (E)-1-(4-bromophenyl)-N-[(E)-(4-bromophenyl)methylideneamino]methanimine is Brc1ccc(/C=N/N=C/c2ccc(Br)cc2)cc1.
What is the InChIKey of (E)-1-(4-bromophenyl)-N-[(E)-(4-bromophenyl)methylideneamino]methanimine?
The InChIKey is LBYGBPAMWPZZRE-BEQMOXJMSA-N. The full InChI is InChI=1S/C14H10Br2N2/c15-13-5-1-11(2-6-13)9-17-18-10-12-3-7-14(16)8-4-12/h1-10H/b17-9+,18-10+.
What are the key properties of (E)-1-(4-bromophenyl)-N-[(E)-(4-bromophenyl)methylideneamino]methanimine?
(E)-1-(4-bromophenyl)-N-[(E)-(4-bromophenyl)methylideneamino]methanimine has a molecular weight of 366.06 g/mol, XLogP of 4.66, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1-(4-bromophenyl)-N-[(E)-(4-bromophenyl)methylideneamino]methanimine is sourced from PubChem (CID 6894308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).