6-(3-bromophenyl)-N-(2,5-difluorophenyl)-2-methylpyridine-3-carboxamide

C19H13BrF2N2O — CID 27005490

IUPAC6-(3-bromophenyl)-N-(2,5-difluorophenyl)-2-methylpyridine-3-carboxamide
SMILESCc1nc(-c2cccc(Br)c2)ccc1C(=O)Nc1cc(F)ccc1F
InChIInChI=1S/C19H13BrF2N2O/c1-11-15(19(25)24-18-10-14(21)5-7-16(18)22)6-8-17(23-11)12-3-2-4-13(20)9-12/h2-10H,1H3,(H,24,25)
InChIKeyYOOKITCAAKMWED-UHFFFAOYSA-N
MW403.23 g/mol
LogP5.35
Rot. Bonds3

About 6-(3-bromophenyl)-N-(2,5-difluorophenyl)-2-methylpyridine-3-carboxamide

6-(3-bromophenyl)-N-(2,5-difluorophenyl)-2-methylpyridine-3-carboxamide (PubChem CID 27005490) has the molecular formula C19H13BrF2N2O and a molecular weight of 403.23 g/mol. Its IUPAC name is 6-(3-bromophenyl)-N-(2,5-difluorophenyl)-2-methylpyridine-3-carboxamide.

Molecular Properties

Compound Name6-(3-bromophenyl)-N-(2,5-difluorophenyl)-2-methylpyridine-3-carboxamide
PubChem CID27005490
Molecular FormulaC19H13BrF2N2O
Molecular Weight403.23 g/mol
Exact Mass402.02
IUPAC Name6-(3-bromophenyl)-N-(2,5-difluorophenyl)-2-methylpyridine-3-carboxamide
SMILESCc1nc(-c2cccc(Br)c2)ccc1C(=O)Nc1cc(F)ccc1F
InChIInChI=1S/C19H13BrF2N2O/c1-11-15(19(25)24-18-10-14(21)5-7-16(18)22)6-8-17(23-11)12-3-2-4-13(20)9-12/h2-10H,1H3,(H,24,25)
InChIKeyYOOKITCAAKMWED-UHFFFAOYSA-N
XLogP5.35
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500403.23
LogP ≤ 55.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-(3-bromophenyl)-N-(4,5-dimethoxy-2-methylphenyl)-2-methylpyridine-3-carboxamide
CID 27286760
6-(3-bromophenyl)-N-(2,5-dimethoxyphenyl)-2-methylpyridine-3-carboxamide
CID 27285916
6-(3-bromophenyl)-N-methoxy-2-methylpyridine-3-carboxamide
CID 30796992
6-(3-bromophenyl)-2-methylpyridine-3-carboxylic acid
CID 7131628
N-(1H-benzimidazol-2-yl)-6-(3-bromophenyl)-2-methylpyridine-3-carboxamide
CID 27649715
6-(3-bromophenyl)-2-methyl-N-[2-(pyrazol-1-ylmethyl)phenyl]pyridine-3-carboxamide
CID 46480790
6-(3-bromophenyl)-N-[4-(dimethylsulfamoyl)phenyl]-2-methylpyridine-3-carboxamide
CID 27018737
6-(3-bromophenyl)-N-[3,5-dimethyl-1-(4-methylphenyl)pyrazol-4-yl]-2-methylpyridine-3-carboxamide
CID 30751977
N-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-2,4-difluorobenzamide
CID 112760887
6-(3-bromophenyl)-2-methyl-N-(6-pyrazol-1-yl-3-pyridinyl)pyridine-3-carboxamide
CID 30822082
2-bromo-N-(2,5-difluorophenyl)-4-fluorobenzamide
CID 24710516
6-(3-bromophenyl)-N-[2-(dimethylamino)-3-methylbutyl]-2-methylpyridine-3-carboxamide
CID 43066460

Frequently Asked Questions

What is the IUPAC name of 6-(3-bromophenyl)-N-(2,5-difluorophenyl)-2-methylpyridine-3-carboxamide?
The IUPAC name of 6-(3-bromophenyl)-N-(2,5-difluorophenyl)-2-methylpyridine-3-carboxamide (CID 27005490) is 6-(3-bromophenyl)-N-(2,5-difluorophenyl)-2-methylpyridine-3-carboxamide.
What is the SMILES notation for 6-(3-bromophenyl)-N-(2,5-difluorophenyl)-2-methylpyridine-3-carboxamide?
The canonical SMILES for 6-(3-bromophenyl)-N-(2,5-difluorophenyl)-2-methylpyridine-3-carboxamide is Cc1nc(-c2cccc(Br)c2)ccc1C(=O)Nc1cc(F)ccc1F.
What is the InChIKey of 6-(3-bromophenyl)-N-(2,5-difluorophenyl)-2-methylpyridine-3-carboxamide?
The InChIKey is YOOKITCAAKMWED-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13BrF2N2O/c1-11-15(19(25)24-18-10-14(21)5-7-16(18)22)6-8-17(23-11)12-3-2-4-13(20)9-12/h2-10H,1H3,(H,24,25).
What are the key properties of 6-(3-bromophenyl)-N-(2,5-difluorophenyl)-2-methylpyridine-3-carboxamide?
6-(3-bromophenyl)-N-(2,5-difluorophenyl)-2-methylpyridine-3-carboxamide has a molecular weight of 403.23 g/mol, XLogP of 5.35, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-bromophenyl)-N-(2,5-difluorophenyl)-2-methylpyridine-3-carboxamide is sourced from PubChem (CID 27005490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).