N-(2-bromo-6-fluorophenyl)-3-(propylamino)pyridine-4-carboxamide

C15H15BrFN3O — CID 107603315

IUPACN-(2-bromo-6-fluorophenyl)-3-(propylamino)pyridine-4-carboxamide
SMILESCCCNc1cnccc1C(=O)Nc1c(F)cccc1Br
InChIInChI=1S/C15H15BrFN3O/c1-2-7-19-13-9-18-8-6-10(13)15(21)20-14-11(16)4-3-5-12(14)17/h3-6,8-9,19H,2,7H2,1H3,(H,20,21)
InChIKeyZEVIZMFHYONALA-UHFFFAOYSA-N
MW352.21 g/mol
LogP4.06
Rot. Bonds5

About N-(2-bromo-6-fluorophenyl)-3-(propylamino)pyridine-4-carboxamide

N-(2-bromo-6-fluorophenyl)-3-(propylamino)pyridine-4-carboxamide (PubChem CID 107603315) has the molecular formula C15H15BrFN3O and a molecular weight of 352.21 g/mol. Its IUPAC name is N-(2-bromo-6-fluorophenyl)-3-(propylamino)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(2-bromo-6-fluorophenyl)-3-(propylamino)pyridine-4-carboxamide
PubChem CID107603315
Molecular FormulaC15H15BrFN3O
Molecular Weight352.21 g/mol
Exact Mass351.04
IUPAC NameN-(2-bromo-6-fluorophenyl)-3-(propylamino)pyridine-4-carboxamide
SMILESCCCNc1cnccc1C(=O)Nc1c(F)cccc1Br
InChIInChI=1S/C15H15BrFN3O/c1-2-7-19-13-9-18-8-6-10(13)15(21)20-14-11(16)4-3-5-12(14)17/h3-6,8-9,19H,2,7H2,1H3,(H,20,21)
InChIKeyZEVIZMFHYONALA-UHFFFAOYSA-N
XLogP4.06
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.21
LogP ≤ 54.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-bromo-4-fluorophenyl)-3-(propylamino)pyridine-4-carboxamide
CID 105071177
N-(2-bromo-3-chlorophenyl)-3-(propylamino)pyridine-4-carboxamide
CID 103481422
3-fluoro-N-(3-fluoro-4-pyridinyl)-2-(propylamino)benzamide
CID 107595462
N-(2,5-dibromophenyl)-3-(propylamino)pyridine-4-carboxamide
CID 105069309
N-(2-bromo-6-fluorophenyl)-4-(propylamino)benzamide
CID 107603351
N-(2-bromo-6-fluorophenyl)-2-(methylamino)benzamide
CID 107601184
N-(2-fluoro-6-methylphenyl)-3-(methylamino)pyridine-4-carboxamide
CID 105071404
3-fluoro-2-(propylamino)-N-pyridin-4-ylbenzamide
CID 62650270
N-(5-methyl-1,3,4-oxadiazol-2-yl)-3-(propylamino)pyridine-4-carboxamide
CID 105071358
N-(2-methoxyphenyl)-3-(propylamino)pyridine-4-carboxamide
CID 105067884
N-(2-bromo-6-fluorophenyl)-2,3-difluoropyridine-4-carboxamide
CID 107470490
4-amino-N-(2-bromo-6-fluorophenyl)-2-(propylamino)-1,3-thiazole-5-carboxamide
CID 107605084

Frequently Asked Questions

What is the IUPAC name of N-(2-bromo-6-fluorophenyl)-3-(propylamino)pyridine-4-carboxamide?
The IUPAC name of N-(2-bromo-6-fluorophenyl)-3-(propylamino)pyridine-4-carboxamide (CID 107603315) is N-(2-bromo-6-fluorophenyl)-3-(propylamino)pyridine-4-carboxamide.
What is the SMILES notation for N-(2-bromo-6-fluorophenyl)-3-(propylamino)pyridine-4-carboxamide?
The canonical SMILES for N-(2-bromo-6-fluorophenyl)-3-(propylamino)pyridine-4-carboxamide is CCCNc1cnccc1C(=O)Nc1c(F)cccc1Br.
What is the InChIKey of N-(2-bromo-6-fluorophenyl)-3-(propylamino)pyridine-4-carboxamide?
The InChIKey is ZEVIZMFHYONALA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15BrFN3O/c1-2-7-19-13-9-18-8-6-10(13)15(21)20-14-11(16)4-3-5-12(14)17/h3-6,8-9,19H,2,7H2,1H3,(H,20,21).
What are the key properties of N-(2-bromo-6-fluorophenyl)-3-(propylamino)pyridine-4-carboxamide?
N-(2-bromo-6-fluorophenyl)-3-(propylamino)pyridine-4-carboxamide has a molecular weight of 352.21 g/mol, XLogP of 4.06, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromo-6-fluorophenyl)-3-(propylamino)pyridine-4-carboxamide is sourced from PubChem (CID 107603315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).