4-[3-(3-methylphenoxy)phenyl]-1H-pyrazolo[5,4-b]pyridine-6-carboxamide

C20H16N4O2 — CID 143380573

IUPAC4-[3-(3-methylphenoxy)phenyl]-1H-pyrazolo[5,4-b]pyridine-6-carboxamide
SMILESCc1cccc(Oc2cccc(-c3cc(C(N)=O)nc4[nH]ncc34)c2)c1
InChIInChI=1S/C20H16N4O2/c1-12-4-2-6-14(8-12)26-15-7-3-5-13(9-15)16-10-18(19(21)25)23-20-17(16)11-22-24-20/h2-11H,1H3,(H2,21,25)(H,22,23,24)
InChIKeySVGKQSYHFRXXCF-UHFFFAOYSA-N
MW344.37 g/mol
LogP3.82
Rot. Bonds4

About 4-[3-(3-methylphenoxy)phenyl]-1H-pyrazolo[5,4-b]pyridine-6-carboxamide

4-[3-(3-methylphenoxy)phenyl]-1H-pyrazolo[5,4-b]pyridine-6-carboxamide (PubChem CID 143380573) has the molecular formula C20H16N4O2 and a molecular weight of 344.37 g/mol. Its IUPAC name is 4-[3-(3-methylphenoxy)phenyl]-1H-pyrazolo[5,4-b]pyridine-6-carboxamide.

Molecular Properties

Compound Name4-[3-(3-methylphenoxy)phenyl]-1H-pyrazolo[5,4-b]pyridine-6-carboxamide
PubChem CID143380573
Molecular FormulaC20H16N4O2
Molecular Weight344.37 g/mol
Exact Mass344.13
IUPAC Name4-[3-(3-methylphenoxy)phenyl]-1H-pyrazolo[5,4-b]pyridine-6-carboxamide
SMILESCc1cccc(Oc2cccc(-c3cc(C(N)=O)nc4[nH]ncc34)c2)c1
InChIInChI=1S/C20H16N4O2/c1-12-4-2-6-14(8-12)26-15-7-3-5-13(9-15)16-10-18(19(21)25)23-20-17(16)11-22-24-20/h2-11H,1H3,(H2,21,25)(H,22,23,24)
InChIKeySVGKQSYHFRXXCF-UHFFFAOYSA-N
XLogP3.82
TPSA93.89 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.37
LogP ≤ 53.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

[4-(6-carbamoyl-1H-pyrazolo[5,4-b]pyridin-4-yl)phenyl] acetate
CID 59805746
4-(2,4-dimethoxyphenyl)-1H-pyrazolo[5,4-b]pyridine-6-carboxamide
CID 59805762
4-(4,6-dimethoxy-1H-indol-3-yl)-1H-pyrazolo[5,4-b]pyridine-6-carboxamide
CID 59805801
5-(3-methylphenyl)-3H-pyrazolo[5,4-c]isoquinoline
CID 90817428
4-(1-prop-2-enylindol-3-yl)-1H-pyrazolo[5,4-b]pyridine-6-carboxamide
CID 59805808
N-[4-(3-methylphenoxy)phenyl]-N'-(5-methyl-1H-pyrazol-4-yl)oxamide
CID 167920541
4-[3-(4-methylphenoxy)phenyl]-5,6,7,8-tetrahydro-1H-pyrazolo[3,4-b][1,7]naphthyridin-5-ol
CID 90710646
2-(3-methylphenoxy)benzamide
CID 70968841
5-amino-4-(3-methylphenyl)-1H-pyridazin-6-one
CID 117127405
5-(3-methylphenoxy)pyridine-2-carbothioamide
CID 113321030
methanesulfonic acid;3-(3-methylphenoxy)pyridine
CID 117068642
1-(3-methoxyphenyl)-9H-pyrido[3,4-b]indole-3-carboxamide
CID 71528865

Frequently Asked Questions

What is the IUPAC name of 4-[3-(3-methylphenoxy)phenyl]-1H-pyrazolo[5,4-b]pyridine-6-carboxamide?
The IUPAC name of 4-[3-(3-methylphenoxy)phenyl]-1H-pyrazolo[5,4-b]pyridine-6-carboxamide (CID 143380573) is 4-[3-(3-methylphenoxy)phenyl]-1H-pyrazolo[5,4-b]pyridine-6-carboxamide.
What is the SMILES notation for 4-[3-(3-methylphenoxy)phenyl]-1H-pyrazolo[5,4-b]pyridine-6-carboxamide?
The canonical SMILES for 4-[3-(3-methylphenoxy)phenyl]-1H-pyrazolo[5,4-b]pyridine-6-carboxamide is Cc1cccc(Oc2cccc(-c3cc(C(N)=O)nc4[nH]ncc34)c2)c1.
What is the InChIKey of 4-[3-(3-methylphenoxy)phenyl]-1H-pyrazolo[5,4-b]pyridine-6-carboxamide?
The InChIKey is SVGKQSYHFRXXCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N4O2/c1-12-4-2-6-14(8-12)26-15-7-3-5-13(9-15)16-10-18(19(21)25)23-20-17(16)11-22-24-20/h2-11H,1H3,(H2,21,25)(H,22,23,24).
What are the key properties of 4-[3-(3-methylphenoxy)phenyl]-1H-pyrazolo[5,4-b]pyridine-6-carboxamide?
4-[3-(3-methylphenoxy)phenyl]-1H-pyrazolo[5,4-b]pyridine-6-carboxamide has a molecular weight of 344.37 g/mol, XLogP of 3.82, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(3-methylphenoxy)phenyl]-1H-pyrazolo[5,4-b]pyridine-6-carboxamide is sourced from PubChem (CID 143380573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).