N-[(2,4-dibromophenyl)methyl]benzamide

C14H11Br2NO — CID 175587612

IUPACN-[(2,4-dibromophenyl)methyl]benzamide
SMILESO=C(NCc1ccc(Br)cc1Br)c1ccccc1
InChIInChI=1S/C14H11Br2NO/c15-12-7-6-11(13(16)8-12)9-17-14(18)10-4-2-1-3-5-10/h1-8H,9H2,(H,17,18)
InChIKeyOPPHQYQTSYSZHN-UHFFFAOYSA-N
MW369.06 g/mol
LogP4.14
Rot. Bonds3

About N-[(2,4-dibromophenyl)methyl]benzamide

N-[(2,4-dibromophenyl)methyl]benzamide (PubChem CID 175587612) has the molecular formula C14H11Br2NO and a molecular weight of 369.06 g/mol. Its IUPAC name is N-[(2,4-dibromophenyl)methyl]benzamide.

Molecular Properties

Compound NameN-[(2,4-dibromophenyl)methyl]benzamide
PubChem CID175587612
Molecular FormulaC14H11Br2NO
Molecular Weight369.06 g/mol
Exact Mass366.92
IUPAC NameN-[(2,4-dibromophenyl)methyl]benzamide
SMILESO=C(NCc1ccc(Br)cc1Br)c1ccccc1
InChIInChI=1S/C14H11Br2NO/c15-12-7-6-11(13(16)8-12)9-17-14(18)10-4-2-1-3-5-10/h1-8H,9H2,(H,17,18)
InChIKeyOPPHQYQTSYSZHN-UHFFFAOYSA-N
XLogP4.14
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.06
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[(5-bromo-2-methoxyphenyl)methyl]benzamide
CID 49172987
N-[[2-(4-bromophenyl)phenyl]methyl]benzamide
CID 134869465
3-(benzamidomethyl)-5-bromo-2-hydroxybenzoic acid
CID 6610599
N-[[5-(benzamidomethyl)-2,4-dimethylphenyl]methyl]benzamide
CID 154149793
N-[(2-bromophenyl)methyl]-3-methylbenzamide
CID 60739134
3,5-dibromo-N-[(2-hydroxyphenyl)methyl]benzamide
CID 103909337
3,5-diamino-N-[(2-bromophenyl)methyl]benzamide
CID 61401694
5-bromo-N-[(2-bromophenyl)methyl]-2-fluorobenzamide
CID 60739201
3-(aminomethyl)-N-[(2-bromophenyl)methyl]benzamide
CID 115161179
N-[2-[(2,5-dibromophenyl)carbamoylamino]ethyl]benzamide
CID 55698403
N-[(4-bromo-2-chlorophenyl)methyl]-4-tert-butylbenzamide
CID 171934642
N-[(5-bromo-2-fluorophenyl)methyl]-4-fluorobenzamide
CID 46460791

Frequently Asked Questions

What is the IUPAC name of N-[(2,4-dibromophenyl)methyl]benzamide?
The IUPAC name of N-[(2,4-dibromophenyl)methyl]benzamide (CID 175587612) is N-[(2,4-dibromophenyl)methyl]benzamide.
What is the SMILES notation for N-[(2,4-dibromophenyl)methyl]benzamide?
The canonical SMILES for N-[(2,4-dibromophenyl)methyl]benzamide is O=C(NCc1ccc(Br)cc1Br)c1ccccc1.
What is the InChIKey of N-[(2,4-dibromophenyl)methyl]benzamide?
The InChIKey is OPPHQYQTSYSZHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11Br2NO/c15-12-7-6-11(13(16)8-12)9-17-14(18)10-4-2-1-3-5-10/h1-8H,9H2,(H,17,18).
What are the key properties of N-[(2,4-dibromophenyl)methyl]benzamide?
N-[(2,4-dibromophenyl)methyl]benzamide has a molecular weight of 369.06 g/mol, XLogP of 4.14, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,4-dibromophenyl)methyl]benzamide is sourced from PubChem (CID 175587612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).