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

C17H13N5O2 — CID 59805740

IUPAC4-(1-acetylindol-3-yl)-1H-pyrazolo[5,4-b]pyridine-6-carboxamide
SMILESCC(=O)n1cc(-c2cc(C(N)=O)nc3[nH]ncc23)c2ccccc21
InChIInChI=1S/C17H13N5O2/c1-9(23)22-8-13(10-4-2-3-5-15(10)22)11-6-14(16(18)24)20-17-12(11)7-19-21-17/h2-8H,1H3,(H2,18,24)(H,19,20,21)
InChIKeyFBHDPZUTNZSORM-UHFFFAOYSA-N
MW319.32 g/mol
LogP2.34
Rot. Bonds2

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

4-(1-acetylindol-3-yl)-1H-pyrazolo[5,4-b]pyridine-6-carboxamide (PubChem CID 59805740) has the molecular formula C17H13N5O2 and a molecular weight of 319.32 g/mol. Its IUPAC name is 4-(1-acetylindol-3-yl)-1H-pyrazolo[5,4-b]pyridine-6-carboxamide.

Molecular Properties

Compound Name4-(1-acetylindol-3-yl)-1H-pyrazolo[5,4-b]pyridine-6-carboxamide
PubChem CID59805740
Molecular FormulaC17H13N5O2
Molecular Weight319.32 g/mol
Exact Mass319.11
IUPAC Name4-(1-acetylindol-3-yl)-1H-pyrazolo[5,4-b]pyridine-6-carboxamide
SMILESCC(=O)n1cc(-c2cc(C(N)=O)nc3[nH]ncc23)c2ccccc21
InChIInChI=1S/C17H13N5O2/c1-9(23)22-8-13(10-4-2-3-5-15(10)22)11-6-14(16(18)24)20-17-12(11)7-19-21-17/h2-8H,1H3,(H2,18,24)(H,19,20,21)
InChIKeyFBHDPZUTNZSORM-UHFFFAOYSA-N
XLogP2.34
TPSA106.66 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.32
LogP ≤ 52.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(1-acetylindol-3-yl)-1H-pyrazolo[5,4-b]pyridine-6-carboxamide?
The IUPAC name of 4-(1-acetylindol-3-yl)-1H-pyrazolo[5,4-b]pyridine-6-carboxamide (CID 59805740) is 4-(1-acetylindol-3-yl)-1H-pyrazolo[5,4-b]pyridine-6-carboxamide.
What is the SMILES notation for 4-(1-acetylindol-3-yl)-1H-pyrazolo[5,4-b]pyridine-6-carboxamide?
The canonical SMILES for 4-(1-acetylindol-3-yl)-1H-pyrazolo[5,4-b]pyridine-6-carboxamide is CC(=O)n1cc(-c2cc(C(N)=O)nc3[nH]ncc23)c2ccccc21.
What is the InChIKey of 4-(1-acetylindol-3-yl)-1H-pyrazolo[5,4-b]pyridine-6-carboxamide?
The InChIKey is FBHDPZUTNZSORM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13N5O2/c1-9(23)22-8-13(10-4-2-3-5-15(10)22)11-6-14(16(18)24)20-17-12(11)7-19-21-17/h2-8H,1H3,(H2,18,24)(H,19,20,21).
What are the key properties of 4-(1-acetylindol-3-yl)-1H-pyrazolo[5,4-b]pyridine-6-carboxamide?
4-(1-acetylindol-3-yl)-1H-pyrazolo[5,4-b]pyridine-6-carboxamide has a molecular weight of 319.32 g/mol, XLogP of 2.34, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-acetylindol-3-yl)-1H-pyrazolo[5,4-b]pyridine-6-carboxamide is sourced from PubChem (CID 59805740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).