2-amino-5-bromo-N-(1,3-dimethylpyrazol-4-yl)pyridine-4-carboxamide

C11H12BrN5O — CID 114194052

IUPAC2-amino-5-bromo-N-(1,3-dimethylpyrazol-4-yl)pyridine-4-carboxamide
SMILESCc1nn(C)cc1NC(=O)c1cc(N)ncc1Br
InChIInChI=1S/C11H12BrN5O/c1-6-9(5-17(2)16-6)15-11(18)7-3-10(13)14-4-8(7)12/h3-5H,1-2H3,(H2,13,14)(H,15,18)
InChIKeyWAJFYGOAZMBXHK-UHFFFAOYSA-N
MW310.16 g/mol
LogP1.72
Rot. Bonds2

About 2-amino-5-bromo-N-(1,3-dimethylpyrazol-4-yl)pyridine-4-carboxamide

2-amino-5-bromo-N-(1,3-dimethylpyrazol-4-yl)pyridine-4-carboxamide (PubChem CID 114194052) has the molecular formula C11H12BrN5O and a molecular weight of 310.16 g/mol. Its IUPAC name is 2-amino-5-bromo-N-(1,3-dimethylpyrazol-4-yl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-amino-5-bromo-N-(1,3-dimethylpyrazol-4-yl)pyridine-4-carboxamide
PubChem CID114194052
Molecular FormulaC11H12BrN5O
Molecular Weight310.16 g/mol
Exact Mass309.02
IUPAC Name2-amino-5-bromo-N-(1,3-dimethylpyrazol-4-yl)pyridine-4-carboxamide
SMILESCc1nn(C)cc1NC(=O)c1cc(N)ncc1Br
InChIInChI=1S/C11H12BrN5O/c1-6-9(5-17(2)16-6)15-11(18)7-3-10(13)14-4-8(7)12/h3-5H,1-2H3,(H2,13,14)(H,15,18)
InChIKeyWAJFYGOAZMBXHK-UHFFFAOYSA-N
XLogP1.72
TPSA85.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.16
LogP ≤ 51.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-amino-N-(1,3-dimethylpyrazol-4-yl)-6-methylpyridine-3-carboxamide
CID 102807226
N-(1,3-dimethylpyrazol-4-yl)-6-methyl-4-(methylamino)pyridine-3-carboxamide
CID 102807225
3-amino-N-(1,3-dimethylpyrazol-4-yl)pyridine-4-carboxamide
CID 102807250
3-bromo-N-(1,3-dimethylpyrazol-4-yl)-5-methylbenzamide
CID 104853786
N-(1,3-dimethylpyrazol-4-yl)-2-fluorobenzamide
CID 39854004
1-chloro-N-(1,3-dimethylpyrazol-4-yl)isoquinoline-4-carboxamide
CID 106766455
6-chloro-N-(1,3-dimethylpyrazol-4-yl)pyrazine-2-carboxamide
CID 106551394
3-amino-N-(1,3-dimethylpyrazol-4-yl)-2-ethoxybenzamide
CID 102803184
2-amino-N-(1,3-dimethylpyrazol-4-yl)-4-methyl-1,3-thiazole-5-carboxamide
CID 104872498
2-amino-N-(1,3-dimethylpyrazol-4-yl)-3-nitrobenzamide
CID 103733966
4-amino-3-chloro-N-(1,3-dimethylpyrazol-4-yl)benzamide
CID 102803289
3-amino-N-(1,3-dimethylpyrazol-4-yl)-5-methyl-1H-pyrazole-4-carboxamide
CID 102806908

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-bromo-N-(1,3-dimethylpyrazol-4-yl)pyridine-4-carboxamide?
The IUPAC name of 2-amino-5-bromo-N-(1,3-dimethylpyrazol-4-yl)pyridine-4-carboxamide (CID 114194052) is 2-amino-5-bromo-N-(1,3-dimethylpyrazol-4-yl)pyridine-4-carboxamide.
What is the SMILES notation for 2-amino-5-bromo-N-(1,3-dimethylpyrazol-4-yl)pyridine-4-carboxamide?
The canonical SMILES for 2-amino-5-bromo-N-(1,3-dimethylpyrazol-4-yl)pyridine-4-carboxamide is Cc1nn(C)cc1NC(=O)c1cc(N)ncc1Br.
What is the InChIKey of 2-amino-5-bromo-N-(1,3-dimethylpyrazol-4-yl)pyridine-4-carboxamide?
The InChIKey is WAJFYGOAZMBXHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12BrN5O/c1-6-9(5-17(2)16-6)15-11(18)7-3-10(13)14-4-8(7)12/h3-5H,1-2H3,(H2,13,14)(H,15,18).
What are the key properties of 2-amino-5-bromo-N-(1,3-dimethylpyrazol-4-yl)pyridine-4-carboxamide?
2-amino-5-bromo-N-(1,3-dimethylpyrazol-4-yl)pyridine-4-carboxamide has a molecular weight of 310.16 g/mol, XLogP of 1.72, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-bromo-N-(1,3-dimethylpyrazol-4-yl)pyridine-4-carboxamide is sourced from PubChem (CID 114194052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).