N-(3-amino-5-bromopyrazin-2-yl)-5-fluoropyridine-2-carboxamide

C10H7BrFN5O — CID 166104185

IUPACN-(3-amino-5-bromopyrazin-2-yl)-5-fluoropyridine-2-carboxamide
SMILESNc1nc(Br)cnc1NC(=O)c1ccc(F)cn1
InChIInChI=1S/C10H7BrFN5O/c11-7-4-15-9(8(13)16-7)17-10(18)6-2-1-5(12)3-14-6/h1-4H,(H2,13,16)(H,15,17,18)
InChIKeyJWKBOMDGYVEZON-UHFFFAOYSA-N
MW312.10 g/mol
LogP1.61
Rot. Bonds2

About N-(3-amino-5-bromopyrazin-2-yl)-5-fluoropyridine-2-carboxamide

N-(3-amino-5-bromopyrazin-2-yl)-5-fluoropyridine-2-carboxamide (PubChem CID 166104185) has the molecular formula C10H7BrFN5O and a molecular weight of 312.10 g/mol. Its IUPAC name is N-(3-amino-5-bromopyrazin-2-yl)-5-fluoropyridine-2-carboxamide.

Molecular Properties

Compound NameN-(3-amino-5-bromopyrazin-2-yl)-5-fluoropyridine-2-carboxamide
PubChem CID166104185
Molecular FormulaC10H7BrFN5O
Molecular Weight312.10 g/mol
Exact Mass310.98
IUPAC NameN-(3-amino-5-bromopyrazin-2-yl)-5-fluoropyridine-2-carboxamide
SMILESNc1nc(Br)cnc1NC(=O)c1ccc(F)cn1
InChIInChI=1S/C10H7BrFN5O/c11-7-4-15-9(8(13)16-7)17-10(18)6-2-1-5(12)3-14-6/h1-4H,(H2,13,16)(H,15,17,18)
InChIKeyJWKBOMDGYVEZON-UHFFFAOYSA-N
XLogP1.61
TPSA93.79 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.10
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3-amino-5-fluorophenyl)-5-fluoropyridine-2-carboxamide
CID 107333949
N-(2-amino-6-bromo-4-methylphenyl)-5-fluoropyridine-2-carboxamide
CID 116813696
N-(3-bromo-4-chlorophenyl)-5-fluoropyridine-2-carboxamide
CID 113411937
N-(3,5-dibromopyrazin-2-yl)-2,5-difluorobenzamide
CID 113255841
5-(18F)fluoropyridine-2-carboxamide
CID 11607925
5-amino-N-(2-bromo-5-fluorophenyl)pyridine-2-carboxamide
CID 107624285
4-bromo-2-[(5-fluoropyridine-2-carbonyl)amino]benzoic acid
CID 104638178
3-bromo-5-[(5-fluoropyridine-2-carbonyl)amino]benzoic acid
CID 104638360
N-(4-amino-5-chloro-2-methylphenyl)-5-fluoropyridine-2-carboxamide
CID 104667498
4-bromo-3-[(5-fluoropyridine-2-carbonyl)amino]benzoic acid
CID 107812529
N-[(4-aminophenyl)methyl]-5-fluoropyridine-2-carboxamide
CID 113435772
5-amino-N-(5-bromopyrazin-2-yl)pyridine-2-carboxamide
CID 81316335

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-5-bromopyrazin-2-yl)-5-fluoropyridine-2-carboxamide?
The IUPAC name of N-(3-amino-5-bromopyrazin-2-yl)-5-fluoropyridine-2-carboxamide (CID 166104185) is N-(3-amino-5-bromopyrazin-2-yl)-5-fluoropyridine-2-carboxamide.
What is the SMILES notation for N-(3-amino-5-bromopyrazin-2-yl)-5-fluoropyridine-2-carboxamide?
The canonical SMILES for N-(3-amino-5-bromopyrazin-2-yl)-5-fluoropyridine-2-carboxamide is Nc1nc(Br)cnc1NC(=O)c1ccc(F)cn1.
What is the InChIKey of N-(3-amino-5-bromopyrazin-2-yl)-5-fluoropyridine-2-carboxamide?
The InChIKey is JWKBOMDGYVEZON-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7BrFN5O/c11-7-4-15-9(8(13)16-7)17-10(18)6-2-1-5(12)3-14-6/h1-4H,(H2,13,16)(H,15,17,18).
What are the key properties of N-(3-amino-5-bromopyrazin-2-yl)-5-fluoropyridine-2-carboxamide?
N-(3-amino-5-bromopyrazin-2-yl)-5-fluoropyridine-2-carboxamide has a molecular weight of 312.10 g/mol, XLogP of 1.61, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-5-bromopyrazin-2-yl)-5-fluoropyridine-2-carboxamide is sourced from PubChem (CID 166104185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).