N-benzyl-4-bromo-N-phenylbenzamide

C20H16BrNO — CID 15817231

IUPACN-benzyl-4-bromo-N-phenylbenzamide
SMILESO=C(c1ccc(Br)cc1)N(Cc1ccccc1)c1ccccc1
InChIInChI=1S/C20H16BrNO/c21-18-13-11-17(12-14-18)20(23)22(19-9-5-2-6-10-19)15-16-7-3-1-4-8-16/h1-14H,15H2
InChIKeyRFJRXQHCLHSMRT-UHFFFAOYSA-N
MW366.26 g/mol
LogP5.30
Rot. Bonds4

About N-benzyl-4-bromo-N-phenylbenzamide

N-benzyl-4-bromo-N-phenylbenzamide (PubChem CID 15817231) has the molecular formula C20H16BrNO and a molecular weight of 366.26 g/mol. Its IUPAC name is N-benzyl-4-bromo-N-phenylbenzamide.

Molecular Properties

Compound NameN-benzyl-4-bromo-N-phenylbenzamide
PubChem CID15817231
Molecular FormulaC20H16BrNO
Molecular Weight366.26 g/mol
Exact Mass365.04
IUPAC NameN-benzyl-4-bromo-N-phenylbenzamide
SMILESO=C(c1ccc(Br)cc1)N(Cc1ccccc1)c1ccccc1
InChIInChI=1S/C20H16BrNO/c21-18-13-11-17(12-14-18)20(23)22(19-9-5-2-6-10-19)15-16-7-3-1-4-8-16/h1-14H,15H2
InChIKeyRFJRXQHCLHSMRT-UHFFFAOYSA-N
XLogP5.30
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500366.26
LogP ≤ 55.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-benzyl-4-chloro-N-phenylbenzamide
CID 20787883
N-benzyl-2-(4-bromophenyl)-N-phenylacetamide
CID 18281131
methyl 4-[benzyl(phenyl)carbamoyl]benzoate
CID 24819418
N-benzyl-4-bromo-N-methylbenzamide
CID 751372
4-bromo-N-butyl-N-phenylbenzamide
CID 3934058
N-benzyl-4-(dimethylsulfamoyl)-N-phenylbenzamide
CID 26731454
1-benzyl-3-[2-(4-bromophenyl)ethyl]-1-phenylurea
CID 108902393
1-N-benzyl-1-N,4-N-diethyl-4-N-phenylbenzene-1,4-dicarboxamide
CID 109047506
N-benzyl-2-(4-bromophenyl)sulfanyl-N-phenylacetamide
CID 39075033
4-bromo-N-[2-(1,3-dioxoisoindol-2-yl)ethyl]-N-phenylbenzamide
CID 4528912
4-bromo-N-hydroxy-N-phenylbenzamide
CID 25115715
N-benzyl-4-(3-methyl-1,2,4-oxadiazol-5-yl)-N-phenylbenzamide
CID 55531278

Frequently Asked Questions

What is the IUPAC name of N-benzyl-4-bromo-N-phenylbenzamide?
The IUPAC name of N-benzyl-4-bromo-N-phenylbenzamide (CID 15817231) is N-benzyl-4-bromo-N-phenylbenzamide.
What is the SMILES notation for N-benzyl-4-bromo-N-phenylbenzamide?
The canonical SMILES for N-benzyl-4-bromo-N-phenylbenzamide is O=C(c1ccc(Br)cc1)N(Cc1ccccc1)c1ccccc1.
What is the InChIKey of N-benzyl-4-bromo-N-phenylbenzamide?
The InChIKey is RFJRXQHCLHSMRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16BrNO/c21-18-13-11-17(12-14-18)20(23)22(19-9-5-2-6-10-19)15-16-7-3-1-4-8-16/h1-14H,15H2.
What are the key properties of N-benzyl-4-bromo-N-phenylbenzamide?
N-benzyl-4-bromo-N-phenylbenzamide has a molecular weight of 366.26 g/mol, XLogP of 5.30, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-4-bromo-N-phenylbenzamide is sourced from PubChem (CID 15817231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).