4-bromo-N-(4-methoxyphenyl)benzamide

C14H12BrNO2 — CID 532153

IUPAC4-bromo-N-(4-methoxyphenyl)benzamide
SMILESCOc1ccc(NC(=O)c2ccc(Br)cc2)cc1
InChIInChI=1S/C14H12BrNO2/c1-18-13-8-6-12(7-9-13)16-14(17)10-2-4-11(15)5-3-10/h2-9H,1H3,(H,16,17)
InChIKeyUPQBUSFVHWZAKF-UHFFFAOYSA-N
MW306.16 g/mol
LogP3.71
Rot. Bonds3

About 4-bromo-N-(4-methoxyphenyl)benzamide

4-bromo-N-(4-methoxyphenyl)benzamide (PubChem CID 532153) has the molecular formula C14H12BrNO2 and a molecular weight of 306.16 g/mol. Its IUPAC name is 4-bromo-N-(4-methoxyphenyl)benzamide.

Molecular Properties

Compound Name4-bromo-N-(4-methoxyphenyl)benzamide
PubChem CID532153
Molecular FormulaC14H12BrNO2
Molecular Weight306.16 g/mol
Exact Mass305.01
IUPAC Name4-bromo-N-(4-methoxyphenyl)benzamide
SMILESCOc1ccc(NC(=O)c2ccc(Br)cc2)cc1
InChIInChI=1S/C14H12BrNO2/c1-18-13-8-6-12(7-9-13)16-14(17)10-2-4-11(15)5-3-10/h2-9H,1H3,(H,16,17)
InChIKeyUPQBUSFVHWZAKF-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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Related Compounds

4-Methoxy-N-(4-methoxyphenyl)benzamide
CID 346815
N-(4-methoxyphenyl)-4-methylbenzamide
CID 531829
4-bromo-N-(2,3-dihydro-1,4-benzodioxin-6-yl)benzamide
CID 732526
N-(4-Methoxyphenyl)benzoic acid amide
CID 139031
4-Methoxy-N-(3-methylphenyl)benzamide
CID 346046
Benzamide, N-(4-ethoxyphenyl)-
CID 203878
N-(4-Methoxyphenyl)-2-hydroxybenzamide
CID 478806
1,2-Benzisoselenazol-3(2H)-one, 2-(4-methoxyphenyl)-
CID 3067568
N-(4-Ethoxyphenyl)-4-methoxybenzamide
CID 584690
P-Tolu-M-anisidide
CID 3977580
4-Chloro-N-(4-methoxyphenyl)benzamide
CID 221848
2-chloro-N-(4-methoxyphenyl)benzamide
CID 346660

Frequently Asked Questions

What is the IUPAC name of 4-bromo-N-(4-methoxyphenyl)benzamide?
The IUPAC name of 4-bromo-N-(4-methoxyphenyl)benzamide (CID 532153) is 4-bromo-N-(4-methoxyphenyl)benzamide.
What is the SMILES notation for 4-bromo-N-(4-methoxyphenyl)benzamide?
The canonical SMILES for 4-bromo-N-(4-methoxyphenyl)benzamide is COc1ccc(NC(=O)c2ccc(Br)cc2)cc1.
What is the InChIKey of 4-bromo-N-(4-methoxyphenyl)benzamide?
The InChIKey is UPQBUSFVHWZAKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12BrNO2/c1-18-13-8-6-12(7-9-13)16-14(17)10-2-4-11(15)5-3-10/h2-9H,1H3,(H,16,17).
What are the key properties of 4-bromo-N-(4-methoxyphenyl)benzamide?
4-bromo-N-(4-methoxyphenyl)benzamide 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 4-bromo-N-(4-methoxyphenyl)benzamide is sourced from PubChem (CID 532153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).