N-[(2-bromophenyl)methylidene]benzamide

C14H10BrNO — CID 135079268

IUPACN-[(2-bromophenyl)methylidene]benzamide
SMILESO=C(/N=C/c1ccccc1Br)c1ccccc1
InChIInChI=1S/C14H10BrNO/c15-13-9-5-4-8-12(13)10-16-14(17)11-6-2-1-3-7-11/h1-10H/b16-10+
InChIKeyHQIUGBVIPMYQEJ-MHWRWJLKSA-N
MW288.14 g/mol
LogP3.71
Rot. Bonds2

About N-[(2-bromophenyl)methylidene]benzamide

N-[(2-bromophenyl)methylidene]benzamide (PubChem CID 135079268) has the molecular formula C14H10BrNO and a molecular weight of 288.14 g/mol. Its IUPAC name is N-[(2-bromophenyl)methylidene]benzamide.

Molecular Properties

Compound NameN-[(2-bromophenyl)methylidene]benzamide
PubChem CID135079268
Molecular FormulaC14H10BrNO
Molecular Weight288.14 g/mol
Exact Mass286.99
IUPAC NameN-[(2-bromophenyl)methylidene]benzamide
SMILESO=C(/N=C/c1ccccc1Br)c1ccccc1
InChIInChI=1S/C14H10BrNO/c15-13-9-5-4-8-12(13)10-16-14(17)11-6-2-1-3-7-11/h1-10H/b16-10+
InChIKeyHQIUGBVIPMYQEJ-MHWRWJLKSA-N
XLogP3.71
TPSA29.43 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.14
LogP ≤ 53.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[(2-bromophenyl)methylidene]benzamide?
The IUPAC name of N-[(2-bromophenyl)methylidene]benzamide (CID 135079268) is N-[(2-bromophenyl)methylidene]benzamide.
What is the SMILES notation for N-[(2-bromophenyl)methylidene]benzamide?
The canonical SMILES for N-[(2-bromophenyl)methylidene]benzamide is O=C(/N=C/c1ccccc1Br)c1ccccc1.
What is the InChIKey of N-[(2-bromophenyl)methylidene]benzamide?
The InChIKey is HQIUGBVIPMYQEJ-MHWRWJLKSA-N. The full InChI is InChI=1S/C14H10BrNO/c15-13-9-5-4-8-12(13)10-16-14(17)11-6-2-1-3-7-11/h1-10H/b16-10+.
What are the key properties of N-[(2-bromophenyl)methylidene]benzamide?
N-[(2-bromophenyl)methylidene]benzamide has a molecular weight of 288.14 g/mol, XLogP of 3.71, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-bromophenyl)methylidene]benzamide is sourced from PubChem (CID 135079268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).