N-(2-bromophenyl)-4-methoxybenzamide

C14H12BrNO2 — CID 5176555

IUPACN-(2-bromophenyl)-4-methoxybenzamide
SMILESCOc1ccc(C(=O)Nc2ccccc2Br)cc1
InChIInChI=1S/C14H12BrNO2/c1-18-11-8-6-10(7-9-11)14(17)16-13-5-3-2-4-12(13)15/h2-9H,1H3,(H,16,17)
InChIKeyWVTLNOAWPGZGHD-UHFFFAOYSA-N
MW306.16 g/mol
LogP3.71
Rot. Bonds3

About N-(2-bromophenyl)-4-methoxybenzamide

N-(2-bromophenyl)-4-methoxybenzamide (PubChem CID 5176555) has the molecular formula C14H12BrNO2 and a molecular weight of 306.16 g/mol. Its IUPAC name is N-(2-bromophenyl)-4-methoxybenzamide.

Molecular Properties

Compound NameN-(2-bromophenyl)-4-methoxybenzamide
PubChem CID5176555
Molecular FormulaC14H12BrNO2
Molecular Weight306.16 g/mol
Exact Mass305.01
IUPAC NameN-(2-bromophenyl)-4-methoxybenzamide
SMILESCOc1ccc(C(=O)Nc2ccccc2Br)cc1
InChIInChI=1S/C14H12BrNO2/c1-18-11-8-6-10(7-9-11)14(17)16-13-5-3-2-4-12(13)15/h2-9H,1H3,(H,16,17)
InChIKeyWVTLNOAWPGZGHD-UHFFFAOYSA-N
XLogP3.71
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.16
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-bromophenyl)-4-methoxybenzamide?
The IUPAC name of N-(2-bromophenyl)-4-methoxybenzamide (CID 5176555) is N-(2-bromophenyl)-4-methoxybenzamide.
What is the SMILES notation for N-(2-bromophenyl)-4-methoxybenzamide?
The canonical SMILES for N-(2-bromophenyl)-4-methoxybenzamide is COc1ccc(C(=O)Nc2ccccc2Br)cc1.
What is the InChIKey of N-(2-bromophenyl)-4-methoxybenzamide?
The InChIKey is WVTLNOAWPGZGHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12BrNO2/c1-18-11-8-6-10(7-9-11)14(17)16-13-5-3-2-4-12(13)15/h2-9H,1H3,(H,16,17).
What are the key properties of N-(2-bromophenyl)-4-methoxybenzamide?
N-(2-bromophenyl)-4-methoxybenzamide has a molecular weight of 306.16 g/mol, XLogP of 3.71, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromophenyl)-4-methoxybenzamide is sourced from PubChem (CID 5176555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).