3,5-dibromo-N-(5-methyl-2-pyridinyl)benzamide

C13H10Br2N2O — CID 103907650

IUPAC3,5-dibromo-N-(5-methyl-2-pyridinyl)benzamide
SMILESCc1ccc(NC(=O)c2cc(Br)cc(Br)c2)nc1
InChIInChI=1S/C13H10Br2N2O/c1-8-2-3-12(16-7-8)17-13(18)9-4-10(14)6-11(15)5-9/h2-7H,1H3,(H,16,17,18)
InChIKeyCZJXBBUGGXUPBB-UHFFFAOYSA-N
MW370.04 g/mol
LogP4.17
Rot. Bonds2

About 3,5-dibromo-N-(5-methyl-2-pyridinyl)benzamide

3,5-dibromo-N-(5-methyl-2-pyridinyl)benzamide (PubChem CID 103907650) has the molecular formula C13H10Br2N2O and a molecular weight of 370.04 g/mol. Its IUPAC name is 3,5-dibromo-N-(5-methyl-2-pyridinyl)benzamide.

Molecular Properties

Compound Name3,5-dibromo-N-(5-methyl-2-pyridinyl)benzamide
PubChem CID103907650
Molecular FormulaC13H10Br2N2O
Molecular Weight370.04 g/mol
Exact Mass367.92
IUPAC Name3,5-dibromo-N-(5-methyl-2-pyridinyl)benzamide
SMILESCc1ccc(NC(=O)c2cc(Br)cc(Br)c2)nc1
InChIInChI=1S/C13H10Br2N2O/c1-8-2-3-12(16-7-8)17-13(18)9-4-10(14)6-11(15)5-9/h2-7H,1H3,(H,16,17,18)
InChIKeyCZJXBBUGGXUPBB-UHFFFAOYSA-N
XLogP4.17
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.04
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(5-bromo-2-pyridinyl)-3,5-dimethylbenzamide
CID 953685
3,5-dichloro-N-(5-methyl-2-pyridinyl)benzamide
CID 5063171
4-bromo-3-methyl-N-(5-methyl-2-pyridinyl)benzamide
CID 113338779
3,5-dibromo-N-(4-methyl-2-pyridinyl)benzamide
CID 113349571
N-(5-methyl-2-pyridinyl)-3,5-bis(trifluoromethyl)benzamide
CID 43016681
5-amino-N-(5-methyl-2-pyridinyl)pyridine-3-carboxamide
CID 110488393
4-(ethylamino)-N-(5-methyl-2-pyridinyl)benzamide
CID 62172642
methyl 3-[(5-methyl-2-pyridinyl)carbamoyl]benzoate
CID 108799744
3,4-dimethoxy-N-(5-methyl-2-pyridinyl)benzamide;hydrochloride
CID 163326261
3-amino-5-methoxy-N-(5-methyl-2-pyridinyl)benzamide
CID 81090786
N-(5-methyl-2-pyridinyl)-4-methylsulfonylbenzamide
CID 16583790
3-chloro-4,5-dimethoxy-N-(5-methyl-2-pyridinyl)benzamide
CID 17395012

Frequently Asked Questions

What is the IUPAC name of 3,5-dibromo-N-(5-methyl-2-pyridinyl)benzamide?
The IUPAC name of 3,5-dibromo-N-(5-methyl-2-pyridinyl)benzamide (CID 103907650) is 3,5-dibromo-N-(5-methyl-2-pyridinyl)benzamide.
What is the SMILES notation for 3,5-dibromo-N-(5-methyl-2-pyridinyl)benzamide?
The canonical SMILES for 3,5-dibromo-N-(5-methyl-2-pyridinyl)benzamide is Cc1ccc(NC(=O)c2cc(Br)cc(Br)c2)nc1.
What is the InChIKey of 3,5-dibromo-N-(5-methyl-2-pyridinyl)benzamide?
The InChIKey is CZJXBBUGGXUPBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10Br2N2O/c1-8-2-3-12(16-7-8)17-13(18)9-4-10(14)6-11(15)5-9/h2-7H,1H3,(H,16,17,18).
What are the key properties of 3,5-dibromo-N-(5-methyl-2-pyridinyl)benzamide?
3,5-dibromo-N-(5-methyl-2-pyridinyl)benzamide has a molecular weight of 370.04 g/mol, XLogP of 4.17, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dibromo-N-(5-methyl-2-pyridinyl)benzamide is sourced from PubChem (CID 103907650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).