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

C17H15N5O3 — CID 59805801

IUPAC4-(4,6-dimethoxy-1H-indol-3-yl)-1H-pyrazolo[5,4-b]pyridine-6-carboxamide
SMILESCOc1cc(OC)c2c(-c3cc(C(N)=O)nc4[nH]ncc34)c[nH]c2c1
InChIInChI=1S/C17H15N5O3/c1-24-8-3-12-15(14(4-8)25-2)10(6-19-12)9-5-13(16(18)23)21-17-11(9)7-20-22-17/h3-7,19H,1-2H3,(H2,18,23)(H,20,21,22)
InChIKeyMLBVYZQUADNTLG-UHFFFAOYSA-N
MW337.34 g/mol
LogP2.22
Rot. Bonds4

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

4-(4,6-dimethoxy-1H-indol-3-yl)-1H-pyrazolo[5,4-b]pyridine-6-carboxamide (PubChem CID 59805801) has the molecular formula C17H15N5O3 and a molecular weight of 337.34 g/mol. Its IUPAC name is 4-(4,6-dimethoxy-1H-indol-3-yl)-1H-pyrazolo[5,4-b]pyridine-6-carboxamide.

Molecular Properties

Compound Name4-(4,6-dimethoxy-1H-indol-3-yl)-1H-pyrazolo[5,4-b]pyridine-6-carboxamide
PubChem CID59805801
Molecular FormulaC17H15N5O3
Molecular Weight337.34 g/mol
Exact Mass337.12
IUPAC Name4-(4,6-dimethoxy-1H-indol-3-yl)-1H-pyrazolo[5,4-b]pyridine-6-carboxamide
SMILESCOc1cc(OC)c2c(-c3cc(C(N)=O)nc4[nH]ncc34)c[nH]c2c1
InChIInChI=1S/C17H15N5O3/c1-24-8-3-12-15(14(4-8)25-2)10(6-19-12)9-5-13(16(18)23)21-17-11(9)7-20-22-17/h3-7,19H,1-2H3,(H2,18,23)(H,20,21,22)
InChIKeyMLBVYZQUADNTLG-UHFFFAOYSA-N
XLogP2.22
TPSA118.91 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.34
LogP ≤ 52.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(4,6-dimethoxy-1H-indol-3-yl)-1H-pyrazolo[5,4-b]pyridine-6-carboxamide?
The IUPAC name of 4-(4,6-dimethoxy-1H-indol-3-yl)-1H-pyrazolo[5,4-b]pyridine-6-carboxamide (CID 59805801) is 4-(4,6-dimethoxy-1H-indol-3-yl)-1H-pyrazolo[5,4-b]pyridine-6-carboxamide.
What is the SMILES notation for 4-(4,6-dimethoxy-1H-indol-3-yl)-1H-pyrazolo[5,4-b]pyridine-6-carboxamide?
The canonical SMILES for 4-(4,6-dimethoxy-1H-indol-3-yl)-1H-pyrazolo[5,4-b]pyridine-6-carboxamide is COc1cc(OC)c2c(-c3cc(C(N)=O)nc4[nH]ncc34)c[nH]c2c1.
What is the InChIKey of 4-(4,6-dimethoxy-1H-indol-3-yl)-1H-pyrazolo[5,4-b]pyridine-6-carboxamide?
The InChIKey is MLBVYZQUADNTLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N5O3/c1-24-8-3-12-15(14(4-8)25-2)10(6-19-12)9-5-13(16(18)23)21-17-11(9)7-20-22-17/h3-7,19H,1-2H3,(H2,18,23)(H,20,21,22).
What are the key properties of 4-(4,6-dimethoxy-1H-indol-3-yl)-1H-pyrazolo[5,4-b]pyridine-6-carboxamide?
4-(4,6-dimethoxy-1H-indol-3-yl)-1H-pyrazolo[5,4-b]pyridine-6-carboxamide has a molecular weight of 337.34 g/mol, XLogP of 2.22, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4,6-dimethoxy-1H-indol-3-yl)-1H-pyrazolo[5,4-b]pyridine-6-carboxamide is sourced from PubChem (CID 59805801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).