6-cyclopropyl-1-propan-2-yl-N-(4-sulfamoylphenyl)pyrazolo[5,4-b]pyridine-4-carboxamide

C19H21N5O3S — CID 9268118

IUPAC6-cyclopropyl-1-propan-2-yl-N-(4-sulfamoylphenyl)pyrazolo[5,4-b]pyridine-4-carboxamide
SMILESCC(C)n1ncc2c(C(=O)Nc3ccc(S(N)(=O)=O)cc3)cc(C3CC3)nc21
InChIInChI=1S/C19H21N5O3S/c1-11(2)24-18-16(10-21-24)15(9-17(23-18)12-3-4-12)19(25)22-13-5-7-14(8-6-13)28(20,26)27/h5-12H,3-4H2,1-2H3,(H,22,25)(H2,20,26,27)
InChIKeyPCGVSZRRVBOKJA-UHFFFAOYSA-N
MW399.48 g/mol
LogP2.79
Rot. Bonds5

About 6-cyclopropyl-1-propan-2-yl-N-(4-sulfamoylphenyl)pyrazolo[5,4-b]pyridine-4-carboxamide

6-cyclopropyl-1-propan-2-yl-N-(4-sulfamoylphenyl)pyrazolo[5,4-b]pyridine-4-carboxamide (PubChem CID 9268118) has the molecular formula C19H21N5O3S and a molecular weight of 399.48 g/mol. Its IUPAC name is 6-cyclopropyl-1-propan-2-yl-N-(4-sulfamoylphenyl)pyrazolo[5,4-b]pyridine-4-carboxamide.

Molecular Properties

Compound Name6-cyclopropyl-1-propan-2-yl-N-(4-sulfamoylphenyl)pyrazolo[5,4-b]pyridine-4-carboxamide
PubChem CID9268118
Molecular FormulaC19H21N5O3S
Molecular Weight399.48 g/mol
Exact Mass399.14
IUPAC Name6-cyclopropyl-1-propan-2-yl-N-(4-sulfamoylphenyl)pyrazolo[5,4-b]pyridine-4-carboxamide
SMILESCC(C)n1ncc2c(C(=O)Nc3ccc(S(N)(=O)=O)cc3)cc(C3CC3)nc21
InChIInChI=1S/C19H21N5O3S/c1-11(2)24-18-16(10-21-24)15(9-17(23-18)12-3-4-12)19(25)22-13-5-7-14(8-6-13)28(20,26)27/h5-12H,3-4H2,1-2H3,(H,22,25)(H2,20,26,27)
InChIKeyPCGVSZRRVBOKJA-UHFFFAOYSA-N
XLogP2.79
TPSA119.97 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500399.48
LogP ≤ 52.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-1-propan-2-yl-N-(4-sulfamoylphenyl)pyrazolo[5,4-b]pyridine-4-carboxamide?
The IUPAC name of 6-cyclopropyl-1-propan-2-yl-N-(4-sulfamoylphenyl)pyrazolo[5,4-b]pyridine-4-carboxamide (CID 9268118) is 6-cyclopropyl-1-propan-2-yl-N-(4-sulfamoylphenyl)pyrazolo[5,4-b]pyridine-4-carboxamide.
What is the SMILES notation for 6-cyclopropyl-1-propan-2-yl-N-(4-sulfamoylphenyl)pyrazolo[5,4-b]pyridine-4-carboxamide?
The canonical SMILES for 6-cyclopropyl-1-propan-2-yl-N-(4-sulfamoylphenyl)pyrazolo[5,4-b]pyridine-4-carboxamide is CC(C)n1ncc2c(C(=O)Nc3ccc(S(N)(=O)=O)cc3)cc(C3CC3)nc21.
What is the InChIKey of 6-cyclopropyl-1-propan-2-yl-N-(4-sulfamoylphenyl)pyrazolo[5,4-b]pyridine-4-carboxamide?
The InChIKey is PCGVSZRRVBOKJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N5O3S/c1-11(2)24-18-16(10-21-24)15(9-17(23-18)12-3-4-12)19(25)22-13-5-7-14(8-6-13)28(20,26)27/h5-12H,3-4H2,1-2H3,(H,22,25)(H2,20,26,27).
What are the key properties of 6-cyclopropyl-1-propan-2-yl-N-(4-sulfamoylphenyl)pyrazolo[5,4-b]pyridine-4-carboxamide?
6-cyclopropyl-1-propan-2-yl-N-(4-sulfamoylphenyl)pyrazolo[5,4-b]pyridine-4-carboxamide has a molecular weight of 399.48 g/mol, XLogP of 2.79, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-1-propan-2-yl-N-(4-sulfamoylphenyl)pyrazolo[5,4-b]pyridine-4-carboxamide is sourced from PubChem (CID 9268118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).