2-[(2-bromobenzoyl)amino]-N-(pyridin-2-ylmethyl)benzamide

C20H16BrN3O2 — CID 26549863

IUPAC2-[(2-bromobenzoyl)amino]-N-(pyridin-2-ylmethyl)benzamide
SMILESO=C(Nc1ccccc1C(=O)NCc1ccccn1)c1ccccc1Br
InChIInChI=1S/C20H16BrN3O2/c21-17-10-3-1-8-15(17)20(26)24-18-11-4-2-9-16(18)19(25)23-13-14-7-5-6-12-22-14/h1-12H,13H2,(H,23,25)(H,24,26)
InChIKeyHPHJYOUXIBAUBT-UHFFFAOYSA-N
MW410.27 g/mol
LogP4.03
Rot. Bonds5

About 2-[(2-bromobenzoyl)amino]-N-(pyridin-2-ylmethyl)benzamide

2-[(2-bromobenzoyl)amino]-N-(pyridin-2-ylmethyl)benzamide (PubChem CID 26549863) has the molecular formula C20H16BrN3O2 and a molecular weight of 410.27 g/mol. Its IUPAC name is 2-[(2-bromobenzoyl)amino]-N-(pyridin-2-ylmethyl)benzamide.

Molecular Properties

Compound Name2-[(2-bromobenzoyl)amino]-N-(pyridin-2-ylmethyl)benzamide
PubChem CID26549863
Molecular FormulaC20H16BrN3O2
Molecular Weight410.27 g/mol
Exact Mass409.04
IUPAC Name2-[(2-bromobenzoyl)amino]-N-(pyridin-2-ylmethyl)benzamide
SMILESO=C(Nc1ccccc1C(=O)NCc1ccccn1)c1ccccc1Br
InChIInChI=1S/C20H16BrN3O2/c21-17-10-3-1-8-15(17)20(26)24-18-11-4-2-9-16(18)19(25)23-13-14-7-5-6-12-22-14/h1-12H,13H2,(H,23,25)(H,24,26)
InChIKeyHPHJYOUXIBAUBT-UHFFFAOYSA-N
XLogP4.03
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.27
LogP ≤ 54.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-acetamido-N-(pyridin-2-ylmethyl)benzamide
CID 783556
2-(2,2-dimethylpropanoylamino)-N-(pyridin-2-ylmethyl)benzamide
CID 134110201
2-(ethylamino)-N-(pyridin-2-ylmethyl)benzamide
CID 62167465
2-[(2-bromobenzoyl)amino]-N-[(4-bromothiophen-2-yl)methyl]benzamide
CID 55972093
2-bromo-3-methyl-N-(pyridin-2-ylmethyl)benzamide
CID 113338677
6-(2-bromoanilino)-N-(pyridin-2-ylmethyl)pyridazine-3-carboxamide
CID 109120909
2,3-dichloro-N-(pyridin-2-ylmethyl)benzamide
CID 1247422
2-[(2-bromobenzoyl)amino]-N-[(4-methoxyphenyl)methyl]benzamide
CID 26549860
2-bromo-N-(pyridin-2-ylmethyl)-5-sulfamoylbenzamide
CID 9414471
2-[(3-chloro-2-hydroxypropyl)amino]-N-(pyridin-2-ylmethyl)benzamide
CID 168638648
2-[(2-bromobenzoyl)amino]-N-[(4-methylsulfonylphenyl)methyl]benzamide
CID 60553703
N-(pyridin-2-ylmethyl)-2-[3-[2-(pyridin-2-ylmethylcarbamoyl)phenoxy]-2,2-bis[[2-(pyridin-2-ylmethylcarbamoyl)phenoxy]methyl]propoxy]benzamide
CID 102035338

Frequently Asked Questions

What is the IUPAC name of 2-[(2-bromobenzoyl)amino]-N-(pyridin-2-ylmethyl)benzamide?
The IUPAC name of 2-[(2-bromobenzoyl)amino]-N-(pyridin-2-ylmethyl)benzamide (CID 26549863) is 2-[(2-bromobenzoyl)amino]-N-(pyridin-2-ylmethyl)benzamide.
What is the SMILES notation for 2-[(2-bromobenzoyl)amino]-N-(pyridin-2-ylmethyl)benzamide?
The canonical SMILES for 2-[(2-bromobenzoyl)amino]-N-(pyridin-2-ylmethyl)benzamide is O=C(Nc1ccccc1C(=O)NCc1ccccn1)c1ccccc1Br.
What is the InChIKey of 2-[(2-bromobenzoyl)amino]-N-(pyridin-2-ylmethyl)benzamide?
The InChIKey is HPHJYOUXIBAUBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16BrN3O2/c21-17-10-3-1-8-15(17)20(26)24-18-11-4-2-9-16(18)19(25)23-13-14-7-5-6-12-22-14/h1-12H,13H2,(H,23,25)(H,24,26).
What are the key properties of 2-[(2-bromobenzoyl)amino]-N-(pyridin-2-ylmethyl)benzamide?
2-[(2-bromobenzoyl)amino]-N-(pyridin-2-ylmethyl)benzamide has a molecular weight of 410.27 g/mol, XLogP of 4.03, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-bromobenzoyl)amino]-N-(pyridin-2-ylmethyl)benzamide is sourced from PubChem (CID 26549863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).