5-[(6-bromopyrazolo[1,5-a]pyridine-3-carbonyl)amino]-6-methylpyridine-3-carboxylic acid

C15H11BrN4O3 — CID 71283671

IUPAC5-[(6-bromopyrazolo[1,5-a]pyridine-3-carbonyl)amino]-6-methylpyridine-3-carboxylic acid
SMILESCc1ncc(C(=O)O)cc1NC(=O)c1cnn2cc(Br)ccc12
InChIInChI=1S/C15H11BrN4O3/c1-8-12(4-9(5-17-8)15(22)23)19-14(21)11-6-18-20-7-10(16)2-3-13(11)20/h2-7H,1H3,(H,19,21)(H,22,23)
InChIKeyMUNVWGIVJYJVMZ-UHFFFAOYSA-N
MW375.18 g/mol
LogP2.75
Rot. Bonds3

About 5-[(6-bromopyrazolo[1,5-a]pyridine-3-carbonyl)amino]-6-methylpyridine-3-carboxylic acid

5-[(6-bromopyrazolo[1,5-a]pyridine-3-carbonyl)amino]-6-methylpyridine-3-carboxylic acid (PubChem CID 71283671) has the molecular formula C15H11BrN4O3 and a molecular weight of 375.18 g/mol. Its IUPAC name is 5-[(6-bromopyrazolo[1,5-a]pyridine-3-carbonyl)amino]-6-methylpyridine-3-carboxylic acid.

Molecular Properties

Compound Name5-[(6-bromopyrazolo[1,5-a]pyridine-3-carbonyl)amino]-6-methylpyridine-3-carboxylic acid
PubChem CID71283671
Molecular FormulaC15H11BrN4O3
Molecular Weight375.18 g/mol
Exact Mass374.00
IUPAC Name5-[(6-bromopyrazolo[1,5-a]pyridine-3-carbonyl)amino]-6-methylpyridine-3-carboxylic acid
SMILESCc1ncc(C(=O)O)cc1NC(=O)c1cnn2cc(Br)ccc12
InChIInChI=1S/C15H11BrN4O3/c1-8-12(4-9(5-17-8)15(22)23)19-14(21)11-6-18-20-7-10(16)2-3-13(11)20/h2-7H,1H3,(H,19,21)(H,22,23)
InChIKeyMUNVWGIVJYJVMZ-UHFFFAOYSA-N
XLogP2.75
TPSA96.59 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.18
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-[(6-bromopyrazolo[1,5-a]pyridine-3-carbonyl)amino]-6-methylpyridine-3-carboxylic acid?
The IUPAC name of 5-[(6-bromopyrazolo[1,5-a]pyridine-3-carbonyl)amino]-6-methylpyridine-3-carboxylic acid (CID 71283671) is 5-[(6-bromopyrazolo[1,5-a]pyridine-3-carbonyl)amino]-6-methylpyridine-3-carboxylic acid.
What is the SMILES notation for 5-[(6-bromopyrazolo[1,5-a]pyridine-3-carbonyl)amino]-6-methylpyridine-3-carboxylic acid?
The canonical SMILES for 5-[(6-bromopyrazolo[1,5-a]pyridine-3-carbonyl)amino]-6-methylpyridine-3-carboxylic acid is Cc1ncc(C(=O)O)cc1NC(=O)c1cnn2cc(Br)ccc12.
What is the InChIKey of 5-[(6-bromopyrazolo[1,5-a]pyridine-3-carbonyl)amino]-6-methylpyridine-3-carboxylic acid?
The InChIKey is MUNVWGIVJYJVMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11BrN4O3/c1-8-12(4-9(5-17-8)15(22)23)19-14(21)11-6-18-20-7-10(16)2-3-13(11)20/h2-7H,1H3,(H,19,21)(H,22,23).
What are the key properties of 5-[(6-bromopyrazolo[1,5-a]pyridine-3-carbonyl)amino]-6-methylpyridine-3-carboxylic acid?
5-[(6-bromopyrazolo[1,5-a]pyridine-3-carbonyl)amino]-6-methylpyridine-3-carboxylic acid has a molecular weight of 375.18 g/mol, XLogP of 2.75, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(6-bromopyrazolo[1,5-a]pyridine-3-carbonyl)amino]-6-methylpyridine-3-carboxylic acid is sourced from PubChem (CID 71283671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).