4,5,6,7-tetrahydro-1H-indazole-3-carbohydrazide

C8H12N4O — CID 2202791

IUPAC4,5,6,7-tetrahydro-1H-indazole-3-carbohydrazide
SMILESNNC(=O)c1n[nH]c2c1CCCC2
InChIInChI=1S/C8H12N4O/c9-10-8(13)7-5-3-1-2-4-6(5)11-12-7/h1-4,9H2,(H,10,13)(H,11,12)
InChIKeyPDZXELLVAZIFCS-UHFFFAOYSA-N
MW180.21 g/mol
LogP-0.11
Rot. Bonds1

About 4,5,6,7-tetrahydro-1H-indazole-3-carbohydrazide

4,5,6,7-tetrahydro-1H-indazole-3-carbohydrazide (PubChem CID 2202791) has the molecular formula C8H12N4O and a molecular weight of 180.21 g/mol. Its IUPAC name is 4,5,6,7-tetrahydro-1H-indazole-3-carbohydrazide.

Molecular Properties

Compound Name4,5,6,7-tetrahydro-1H-indazole-3-carbohydrazide
PubChem CID2202791
Molecular FormulaC8H12N4O
Molecular Weight180.21 g/mol
Exact Mass180.10
IUPAC Name4,5,6,7-tetrahydro-1H-indazole-3-carbohydrazide
SMILESNNC(=O)c1n[nH]c2c1CCCC2
InChIInChI=1S/C8H12N4O/c9-10-8(13)7-5-3-1-2-4-6(5)11-12-7/h1-4,9H2,(H,10,13)(H,11,12)
InChIKeyPDZXELLVAZIFCS-UHFFFAOYSA-N
XLogP-0.11
TPSA83.80 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.21
LogP ≤ 5-0.11
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

5-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1H-indazole-3-carbohydrazide
CID 2874138
N'-cyclopentylidene-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-3-carbohydrazide
CID 820020
N-(cyclopentylideneamino)-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide
CID 820033
5-cyclohexyl-4,5,6,7-tetrahydro-1H-indazole-3-carbohydrazide
CID 25161469
2,2,6,6-tetramethyl-4-(2-(4,5,6,7-tetrahydro-1H-indazole-3-carbonyl)hydrazono)piperidinium
CID 801131
4,5,6,7-tetrahydro-1H-indazole-3-carboxamide
CID 28358792
4,5,6,7-tetrahydro-1H-indazole-3-carbaldehyde
CID 28808664
1H,4H,5H,6H-cyclopenta[c]pyrazole-3-carboxamide
CID 45121258
5-propyl-4,5,6,7-tetrahydro-1H-indazole-3-carbohydrazide
CID 25163411
N'-cyclohexylidene-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-3-carbohydrazide
CID 820016
1,4,5,6-Tetrahydrocyclopenta[c]pyrazole-3-carbohydrazide
CID 776841
4,5,6,7,8,9,10,11,12,13-decahydro-1H-cyclododeca[c]pyrazole-3-carbohydrazide
CID 854804

Frequently Asked Questions

What is the IUPAC name of 4,5,6,7-tetrahydro-1H-indazole-3-carbohydrazide?
The IUPAC name of 4,5,6,7-tetrahydro-1H-indazole-3-carbohydrazide (CID 2202791) is 4,5,6,7-tetrahydro-1H-indazole-3-carbohydrazide.
What is the SMILES notation for 4,5,6,7-tetrahydro-1H-indazole-3-carbohydrazide?
The canonical SMILES for 4,5,6,7-tetrahydro-1H-indazole-3-carbohydrazide is NNC(=O)c1n[nH]c2c1CCCC2.
What is the InChIKey of 4,5,6,7-tetrahydro-1H-indazole-3-carbohydrazide?
The InChIKey is PDZXELLVAZIFCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N4O/c9-10-8(13)7-5-3-1-2-4-6(5)11-12-7/h1-4,9H2,(H,10,13)(H,11,12).
What are the key properties of 4,5,6,7-tetrahydro-1H-indazole-3-carbohydrazide?
4,5,6,7-tetrahydro-1H-indazole-3-carbohydrazide has a molecular weight of 180.21 g/mol, XLogP of -0.11, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5,6,7-tetrahydro-1H-indazole-3-carbohydrazide is sourced from PubChem (CID 2202791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).