N-[(3-bromo-4-hydroxyphenyl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide

C15H12BrN3O2 — CID 122146876

IUPACN-[(3-bromo-4-hydroxyphenyl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide
SMILESO=C(NCc1ccc(O)c(Br)c1)c1cnn2ccccc12
InChIInChI=1S/C15H12BrN3O2/c16-12-7-10(4-5-14(12)20)8-17-15(21)11-9-18-19-6-2-1-3-13(11)19/h1-7,9,20H,8H2,(H,17,21)
InChIKeyBPJTYWBISONSRG-UHFFFAOYSA-N
MW346.18 g/mol
LogP2.73
Rot. Bonds3

About N-[(3-bromo-4-hydroxyphenyl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide

N-[(3-bromo-4-hydroxyphenyl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide (PubChem CID 122146876) has the molecular formula C15H12BrN3O2 and a molecular weight of 346.18 g/mol. Its IUPAC name is N-[(3-bromo-4-hydroxyphenyl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[(3-bromo-4-hydroxyphenyl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide
PubChem CID122146876
Molecular FormulaC15H12BrN3O2
Molecular Weight346.18 g/mol
Exact Mass345.01
IUPAC NameN-[(3-bromo-4-hydroxyphenyl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide
SMILESO=C(NCc1ccc(O)c(Br)c1)c1cnn2ccccc12
InChIInChI=1S/C15H12BrN3O2/c16-12-7-10(4-5-14(12)20)8-17-15(21)11-9-18-19-6-2-1-3-13(11)19/h1-7,9,20H,8H2,(H,17,21)
InChIKeyBPJTYWBISONSRG-UHFFFAOYSA-N
XLogP2.73
TPSA66.63 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.18
LogP ≤ 52.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(5-amino-1H-pyrazol-4-yl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide
CID 103120944
N-(2-methylprop-2-enyl)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 104955628
N-[[2-(chloromethyl)cyclopentyl]methyl]pyrazolo[1,5-a]pyridine-3-carboxamide
CID 103122654
N-[2-(ethylamino)ethyl]pyrazolo[1,5-a]pyridine-3-carboxamide
CID 113265553
(2S)-2-hydroxy-3-(pyrazolo[1,5-a]pyridine-3-carbonylamino)propanoic acid
CID 107833160
N-(3-cyanopropyl)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 113412163
N-[2-(propylamino)ethyl]pyrazolo[1,5-a]pyridine-3-carboxamide
CID 113336480
N-(2-ethyl-2-hydroxybutyl)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 103711850
N-(5-chloropentyl)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 107320901
N-(4-bromopentyl)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 114147488
N-(4-bromo-2,2-dimethylbutyl)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 114149424
N-(3-bromo-4-pyridinyl)pyrazolo[1,5-a]pyridine-3-carboxamide
CID 103874376

Frequently Asked Questions

What is the IUPAC name of N-[(3-bromo-4-hydroxyphenyl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide?
The IUPAC name of N-[(3-bromo-4-hydroxyphenyl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide (CID 122146876) is N-[(3-bromo-4-hydroxyphenyl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide.
What is the SMILES notation for N-[(3-bromo-4-hydroxyphenyl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide?
The canonical SMILES for N-[(3-bromo-4-hydroxyphenyl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide is O=C(NCc1ccc(O)c(Br)c1)c1cnn2ccccc12.
What is the InChIKey of N-[(3-bromo-4-hydroxyphenyl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide?
The InChIKey is BPJTYWBISONSRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12BrN3O2/c16-12-7-10(4-5-14(12)20)8-17-15(21)11-9-18-19-6-2-1-3-13(11)19/h1-7,9,20H,8H2,(H,17,21).
What are the key properties of N-[(3-bromo-4-hydroxyphenyl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide?
N-[(3-bromo-4-hydroxyphenyl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide has a molecular weight of 346.18 g/mol, XLogP of 2.73, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-bromo-4-hydroxyphenyl)methyl]pyrazolo[1,5-a]pyridine-3-carboxamide is sourced from PubChem (CID 122146876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).