4-[5-(aminomethyl)pyrazolo[5,4-b]pyridin-1-yl]phenol

C13H12N4O — CID 115043642

IUPAC4-[5-(aminomethyl)pyrazolo[5,4-b]pyridin-1-yl]phenol
SMILESNCc1cnc2c(cnn2-c2ccc(O)cc2)c1
InChIInChI=1S/C13H12N4O/c14-6-9-5-10-8-16-17(13(10)15-7-9)11-1-3-12(18)4-2-11/h1-5,7-8,18H,6,14H2
InChIKeySCFBWGXKHRFYOA-UHFFFAOYSA-N
MW240.27 g/mol
LogP1.58
Rot. Bonds2

About 4-[5-(aminomethyl)pyrazolo[5,4-b]pyridin-1-yl]phenol

4-[5-(aminomethyl)pyrazolo[5,4-b]pyridin-1-yl]phenol (PubChem CID 115043642) has the molecular formula C13H12N4O and a molecular weight of 240.27 g/mol. Its IUPAC name is 4-[5-(aminomethyl)pyrazolo[5,4-b]pyridin-1-yl]phenol.

Molecular Properties

Compound Name4-[5-(aminomethyl)pyrazolo[5,4-b]pyridin-1-yl]phenol
PubChem CID115043642
Molecular FormulaC13H12N4O
Molecular Weight240.27 g/mol
Exact Mass240.10
IUPAC Name4-[5-(aminomethyl)pyrazolo[5,4-b]pyridin-1-yl]phenol
SMILESNCc1cnc2c(cnn2-c2ccc(O)cc2)c1
InChIInChI=1S/C13H12N4O/c14-6-9-5-10-8-16-17(13(10)15-7-9)11-1-3-12(18)4-2-11/h1-5,7-8,18H,6,14H2
InChIKeySCFBWGXKHRFYOA-UHFFFAOYSA-N
XLogP1.58
TPSA76.96 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.27
LogP ≤ 51.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

[1-(4-methylphenyl)pyrazolo[5,4-b]pyridin-5-yl]methanamine
CID 115042606
4-[4-(aminomethyl)-5-fluoropyrazol-1-yl]phenol
CID 115025014
(4-pyrazolo[5,4-c]pyridin-1-ylphenyl)methanamine
CID 174683472
4-[3-(aminomethyl)-5-methylpyrazol-1-yl]phenol
CID 115022979
[1-(2-trimethylsilylethoxymethyl)pyrazolo[5,4-b]pyridin-5-yl]methanamine
CID 171465915
6,8-dihydroxy-2-(4-hydroxyphenyl)phthalazin-1-one
CID 141488259
2-[5-amino-1-(4-hydroxyphenyl)pyrazol-4-yl]acetonitrile
CID 131484759
2-(1-methylpyrazolo[5,4-b]pyridin-5-yl)ethanamine
CID 19620145
4-[5-(2-cyclobutylsulfanylethyl)pyrazolo[5,4-b]pyridin-1-yl]benzoic acid
CID 178125441
4-(5-amino-4-chloropyrazol-1-yl)phenol
CID 112711594
4-(1-methylpyrazolo[3,4-b]pyridin-5-yl)phenol
CID 139537130
1-(4-methylphenyl)pyrazolo[5,4-b]pyridine-5-carbonitrile
CID 115040096

Frequently Asked Questions

What is the IUPAC name of 4-[5-(aminomethyl)pyrazolo[5,4-b]pyridin-1-yl]phenol?
The IUPAC name of 4-[5-(aminomethyl)pyrazolo[5,4-b]pyridin-1-yl]phenol (CID 115043642) is 4-[5-(aminomethyl)pyrazolo[5,4-b]pyridin-1-yl]phenol.
What is the SMILES notation for 4-[5-(aminomethyl)pyrazolo[5,4-b]pyridin-1-yl]phenol?
The canonical SMILES for 4-[5-(aminomethyl)pyrazolo[5,4-b]pyridin-1-yl]phenol is NCc1cnc2c(cnn2-c2ccc(O)cc2)c1.
What is the InChIKey of 4-[5-(aminomethyl)pyrazolo[5,4-b]pyridin-1-yl]phenol?
The InChIKey is SCFBWGXKHRFYOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N4O/c14-6-9-5-10-8-16-17(13(10)15-7-9)11-1-3-12(18)4-2-11/h1-5,7-8,18H,6,14H2.
What are the key properties of 4-[5-(aminomethyl)pyrazolo[5,4-b]pyridin-1-yl]phenol?
4-[5-(aminomethyl)pyrazolo[5,4-b]pyridin-1-yl]phenol has a molecular weight of 240.27 g/mol, XLogP of 1.58, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-(aminomethyl)pyrazolo[5,4-b]pyridin-1-yl]phenol is sourced from PubChem (CID 115043642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).