4-amino-N-(5-bromo-4-methyl-2-pyridinyl)-1H-pyrazole-5-carboxamide

C10H10BrN5O — CID 79734498

IUPAC4-amino-N-(5-bromo-4-methyl-2-pyridinyl)-1H-pyrazole-5-carboxamide
SMILESCc1cc(NC(=O)c2[nH]ncc2N)ncc1Br
InChIInChI=1S/C10H10BrN5O/c1-5-2-8(13-3-6(5)11)15-10(17)9-7(12)4-14-16-9/h2-4H,12H2,1H3,(H,14,16)(H,13,15,17)
InChIKeyARDWKAHWTUXDNK-UHFFFAOYSA-N
MW296.13 g/mol
LogP1.71
Rot. Bonds2

About 4-amino-N-(5-bromo-4-methyl-2-pyridinyl)-1H-pyrazole-5-carboxamide

4-amino-N-(5-bromo-4-methyl-2-pyridinyl)-1H-pyrazole-5-carboxamide (PubChem CID 79734498) has the molecular formula C10H10BrN5O and a molecular weight of 296.13 g/mol. Its IUPAC name is 4-amino-N-(5-bromo-4-methyl-2-pyridinyl)-1H-pyrazole-5-carboxamide.

Molecular Properties

Compound Name4-amino-N-(5-bromo-4-methyl-2-pyridinyl)-1H-pyrazole-5-carboxamide
PubChem CID79734498
Molecular FormulaC10H10BrN5O
Molecular Weight296.13 g/mol
Exact Mass295.01
IUPAC Name4-amino-N-(5-bromo-4-methyl-2-pyridinyl)-1H-pyrazole-5-carboxamide
SMILESCc1cc(NC(=O)c2[nH]ncc2N)ncc1Br
InChIInChI=1S/C10H10BrN5O/c1-5-2-8(13-3-6(5)11)15-10(17)9-7(12)4-14-16-9/h2-4H,12H2,1H3,(H,14,16)(H,13,15,17)
InChIKeyARDWKAHWTUXDNK-UHFFFAOYSA-N
XLogP1.71
TPSA96.69 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.13
LogP ≤ 51.71
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-N-(4-methyl-2-pyridinyl)-1H-pyrazole-5-carboxamide
CID 63107417
4-amino-N-(5-bromo-4-methyl-2-pyridinyl)-3-methylbenzamide
CID 79733791
3-amino-N-(5-bromo-4-methyl-2-pyridinyl)-1H-1,2,4-triazole-5-carboxamide
CID 79733803
3,5-diamino-N-(5-bromo-4-methyl-2-pyridinyl)benzamide
CID 79734210
3-amino-5-bromo-N-(5-bromo-4-methyl-2-pyridinyl)-2-methylbenzamide
CID 107872932
4-amino-N-(5-bromo-4-methyl-2-pyridinyl)-3-fluorobenzamide
CID 79734700
3-amino-N-(5-bromo-4-methyl-2-pyridinyl)-4-chlorobenzamide
CID 79733686
5-bromo-4-methylpyridin-2-amine;N-(5-bromo-4-methyl-2-pyridinyl)acetamide
CID 162076548
5-amino-N-(5-bromo-4-methyl-2-pyridinyl)-1H-indole-2-carboxamide
CID 79735742
4-amino-N-pyrazin-2-yl-1H-pyrazole-5-carboxamide
CID 63102658
3-bromo-N-(5-bromo-4-methyl-2-pyridinyl)-4-methylbenzamide
CID 81472094
2-bromo-N-(5-bromo-4-methyl-2-pyridinyl)acetamide
CID 79734217

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(5-bromo-4-methyl-2-pyridinyl)-1H-pyrazole-5-carboxamide?
The IUPAC name of 4-amino-N-(5-bromo-4-methyl-2-pyridinyl)-1H-pyrazole-5-carboxamide (CID 79734498) is 4-amino-N-(5-bromo-4-methyl-2-pyridinyl)-1H-pyrazole-5-carboxamide.
What is the SMILES notation for 4-amino-N-(5-bromo-4-methyl-2-pyridinyl)-1H-pyrazole-5-carboxamide?
The canonical SMILES for 4-amino-N-(5-bromo-4-methyl-2-pyridinyl)-1H-pyrazole-5-carboxamide is Cc1cc(NC(=O)c2[nH]ncc2N)ncc1Br.
What is the InChIKey of 4-amino-N-(5-bromo-4-methyl-2-pyridinyl)-1H-pyrazole-5-carboxamide?
The InChIKey is ARDWKAHWTUXDNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10BrN5O/c1-5-2-8(13-3-6(5)11)15-10(17)9-7(12)4-14-16-9/h2-4H,12H2,1H3,(H,14,16)(H,13,15,17).
What are the key properties of 4-amino-N-(5-bromo-4-methyl-2-pyridinyl)-1H-pyrazole-5-carboxamide?
4-amino-N-(5-bromo-4-methyl-2-pyridinyl)-1H-pyrazole-5-carboxamide has a molecular weight of 296.13 g/mol, XLogP of 1.71, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(5-bromo-4-methyl-2-pyridinyl)-1H-pyrazole-5-carboxamide is sourced from PubChem (CID 79734498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).