2,6-dihydropyrazolo[3,4-e]indazole-3-carboxamide

C9H7N5O — CID 5331022

IUPAC2,6-dihydropyrazolo[3,4-e]indazole-3-carboxamide
SMILESNC(=O)c1[nH]nc2c1ccc1[nH]ncc12
InChIInChI=1S/C9H7N5O/c10-9(15)8-4-1-2-6-5(3-11-12-6)7(4)13-14-8/h1-3H,(H2,10,15)(H,11,12)(H,13,14)
InChIKeyKWKWTBFZIUSWFJ-UHFFFAOYSA-N
MW201.19 g/mol
LogP0.54
Rot. Bonds1

About 2,6-dihydropyrazolo[3,4-e]indazole-3-carboxamide

2,6-dihydropyrazolo[3,4-e]indazole-3-carboxamide (PubChem CID 5331022) has the molecular formula C9H7N5O and a molecular weight of 201.19 g/mol. Its IUPAC name is 2,6-dihydropyrazolo[3,4-e]indazole-3-carboxamide.

Molecular Properties

Compound Name2,6-dihydropyrazolo[3,4-e]indazole-3-carboxamide
PubChem CID5331022
Molecular FormulaC9H7N5O
Molecular Weight201.19 g/mol
Exact Mass201.07
IUPAC Name2,6-dihydropyrazolo[3,4-e]indazole-3-carboxamide
SMILESNC(=O)c1[nH]nc2c1ccc1[nH]ncc12
InChIInChI=1S/C9H7N5O/c10-9(15)8-4-1-2-6-5(3-11-12-6)7(4)13-14-8/h1-3H,(H2,10,15)(H,11,12)(H,13,14)
InChIKeyKWKWTBFZIUSWFJ-UHFFFAOYSA-N
XLogP0.54
TPSA100.45 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.19
LogP ≤ 50.54
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

1H-Indazole-3-carboxamide
CID 20978176
Tetrahydro-benzodipyrazole deriv. 7g
CID 5331021
Tetrahydro-benzodipyrazole deriv. 7h
CID 135403024
Tetrahydro-benzodipyrazole deriv. 7i
CID 135403025
1H-Indazole-6-carboxamide
CID 22360481
(2s)-2-Cyano-3-(1h-Indazol-5-Yl)propanamide
CID 78225350
1-(butylsulfamoyl)-5,6-dihydro-4H-pyrazolo[5,4-e]indazole-3-carboxamide
CID 136132247
N-[(3S,4S)-3-fluoro-1-(2-methylpropyl)piperidin-4-yl]-5-(1H-pyrazol-4-yl)-1H-indazole-3-carboxamide
CID 139431529
N-[1-(2-fluoro-2-methylpropyl)piperidin-4-yl]-5-(1H-pyrazol-4-yl)-1H-indazole-3-carboxamide
CID 139431534
1H-Indazole-5-carboxaldehyde
CID 21250644
1-(1H-Indazol-5-yl)ethan-1-one
CID 39103988
3-methyl-N-[3-[[3-(1H-pyrazol-4-yl)-1H-indazol-6-yl]amino]phenyl]benzamide
CID 176216953

Frequently Asked Questions

What is the IUPAC name of 2,6-dihydropyrazolo[3,4-e]indazole-3-carboxamide?
The IUPAC name of 2,6-dihydropyrazolo[3,4-e]indazole-3-carboxamide (CID 5331022) is 2,6-dihydropyrazolo[3,4-e]indazole-3-carboxamide.
What is the SMILES notation for 2,6-dihydropyrazolo[3,4-e]indazole-3-carboxamide?
The canonical SMILES for 2,6-dihydropyrazolo[3,4-e]indazole-3-carboxamide is NC(=O)c1[nH]nc2c1ccc1[nH]ncc12.
What is the InChIKey of 2,6-dihydropyrazolo[3,4-e]indazole-3-carboxamide?
The InChIKey is KWKWTBFZIUSWFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7N5O/c10-9(15)8-4-1-2-6-5(3-11-12-6)7(4)13-14-8/h1-3H,(H2,10,15)(H,11,12)(H,13,14).
What are the key properties of 2,6-dihydropyrazolo[3,4-e]indazole-3-carboxamide?
2,6-dihydropyrazolo[3,4-e]indazole-3-carboxamide has a molecular weight of 201.19 g/mol, XLogP of 0.54, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dihydropyrazolo[3,4-e]indazole-3-carboxamide is sourced from PubChem (CID 5331022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).