5-bromo-N-[2-methyl-5-(5-methyltetrazol-2-yl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide

C17H14BrN7O — CID 171655813

IUPAC5-bromo-N-[2-methyl-5-(5-methyltetrazol-2-yl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide
SMILESCc1nnn(-c2ccc(C)c(NC(=O)c3cnn4ccc(Br)cc34)c2)n1
InChIInChI=1S/C17H14BrN7O/c1-10-3-4-13(25-22-11(2)21-23-25)8-15(10)20-17(26)14-9-19-24-6-5-12(18)7-16(14)24/h3-9H,1-2H3,(H,20,26)
InChIKeyNXAZPQKAFGZEAK-UHFFFAOYSA-N
MW412.25 g/mol
LogP2.94
Rot. Bonds3

About 5-bromo-N-[2-methyl-5-(5-methyltetrazol-2-yl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide

5-bromo-N-[2-methyl-5-(5-methyltetrazol-2-yl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide (PubChem CID 171655813) has the molecular formula C17H14BrN7O and a molecular weight of 412.25 g/mol. Its IUPAC name is 5-bromo-N-[2-methyl-5-(5-methyltetrazol-2-yl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide.

Molecular Properties

Compound Name5-bromo-N-[2-methyl-5-(5-methyltetrazol-2-yl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide
PubChem CID171655813
Molecular FormulaC17H14BrN7O
Molecular Weight412.25 g/mol
Exact Mass411.04
IUPAC Name5-bromo-N-[2-methyl-5-(5-methyltetrazol-2-yl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide
SMILESCc1nnn(-c2ccc(C)c(NC(=O)c3cnn4ccc(Br)cc34)c2)n1
InChIInChI=1S/C17H14BrN7O/c1-10-3-4-13(25-22-11(2)21-23-25)8-15(10)20-17(26)14-9-19-24-6-5-12(18)7-16(14)24/h3-9H,1-2H3,(H,20,26)
InChIKeyNXAZPQKAFGZEAK-UHFFFAOYSA-N
XLogP2.94
TPSA90.00 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500412.25
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-[5-[5-(1-cyclopropylsulfonylazetidin-3-yl)tetrazol-2-yl]-2-methylphenyl]pyrazolo[1,5-a]pyridine-3-carboxamide
CID 171656565
methyl 3-[2-[3-[(5-bromopyrazolo[1,5-a]pyridine-3-carbonyl)amino]-4-chlorophenyl]triazol-4-yl]azetidine-1-carboxylate
CID 171655761
5-[1-(2-hydroxyethyl)pyrazol-4-yl]-N-[2-methyl-5-(4-methyltriazol-2-yl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide
CID 171655738
N-(4-amino-2,5-dimethylphenyl)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 103144411
5-bromo-N-[2-chloro-5-[2-(3,3-difluorocyclobutyl)tetrazol-5-yl]-4-fluorophenyl]pyrazolo[1,5-a]pyridine-3-carboxamide
CID 171655800
5-bromo-N-[2-(hydroxymethyl)-2-methylbutyl]pyrazolo[1,5-a]pyridine-3-carboxamide
CID 166672990
N-(2-amino-4-bromophenyl)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 103115989
N-[5-(6-cyclopropyl-3-pyridinyl)-2-methylphenyl]-5-(2-oxa-6-azaspiro[3.3]heptan-6-yl)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 175682875
N-(5-bromo-2-methylphenyl)benzamide;N-(2-methyl-5-pyrrol-1-ylphenyl)benzamide
CID 158601564
methyl 3-[5-[3-[(6-bromopyrazolo[1,5-a]pyridine-3-carbonyl)amino]-4-methylphenyl]tetrazol-2-yl]azetidine-1-carboxylate
CID 171656556
N-[5-(5-cyclopropylpyrazin-2-yl)-2-methylphenyl]-5-(2-oxa-6-azaspiro[3.3]heptan-6-yl)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 175682874
N-(5-bromo-2-methylphenyl)-2,5-dimethylpyrazole-3-carboxamide
CID 61061508

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-[2-methyl-5-(5-methyltetrazol-2-yl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide?
The IUPAC name of 5-bromo-N-[2-methyl-5-(5-methyltetrazol-2-yl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide (CID 171655813) is 5-bromo-N-[2-methyl-5-(5-methyltetrazol-2-yl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide.
What is the SMILES notation for 5-bromo-N-[2-methyl-5-(5-methyltetrazol-2-yl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide?
The canonical SMILES for 5-bromo-N-[2-methyl-5-(5-methyltetrazol-2-yl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide is Cc1nnn(-c2ccc(C)c(NC(=O)c3cnn4ccc(Br)cc34)c2)n1.
What is the InChIKey of 5-bromo-N-[2-methyl-5-(5-methyltetrazol-2-yl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide?
The InChIKey is NXAZPQKAFGZEAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14BrN7O/c1-10-3-4-13(25-22-11(2)21-23-25)8-15(10)20-17(26)14-9-19-24-6-5-12(18)7-16(14)24/h3-9H,1-2H3,(H,20,26).
What are the key properties of 5-bromo-N-[2-methyl-5-(5-methyltetrazol-2-yl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide?
5-bromo-N-[2-methyl-5-(5-methyltetrazol-2-yl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide has a molecular weight of 412.25 g/mol, XLogP of 2.94, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-[2-methyl-5-(5-methyltetrazol-2-yl)phenyl]pyrazolo[1,5-a]pyridine-3-carboxamide is sourced from PubChem (CID 171655813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).