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

C11H18N4O — CID 25163411

IUPAC5-propyl-4,5,6,7-tetrahydro-1H-indazole-3-carbohydrazide
SMILESCCCC1CCc2[nH]nc(C(=O)NN)c2C1
InChIInChI=1S/C11H18N4O/c1-2-3-7-4-5-9-8(6-7)10(15-14-9)11(16)13-12/h7H,2-6,12H2,1H3,(H,13,16)(H,14,15)
InChIKeyWRCCTRXGCPABER-UHFFFAOYSA-N
MW222.29 g/mol
LogP0.92
Rot. Bonds3

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

5-propyl-4,5,6,7-tetrahydro-1H-indazole-3-carbohydrazide (PubChem CID 25163411) has the molecular formula C11H18N4O and a molecular weight of 222.29 g/mol. Its IUPAC name is 5-propyl-4,5,6,7-tetrahydro-1H-indazole-3-carbohydrazide.

Molecular Properties

Compound Name5-propyl-4,5,6,7-tetrahydro-1H-indazole-3-carbohydrazide
PubChem CID25163411
Molecular FormulaC11H18N4O
Molecular Weight222.29 g/mol
Exact Mass222.15
IUPAC Name5-propyl-4,5,6,7-tetrahydro-1H-indazole-3-carbohydrazide
SMILESCCCC1CCc2[nH]nc(C(=O)NN)c2C1
InChIInChI=1S/C11H18N4O/c1-2-3-7-4-5-9-8(6-7)10(15-14-9)11(16)13-12/h7H,2-6,12H2,1H3,(H,13,16)(H,14,15)
InChIKeyWRCCTRXGCPABER-UHFFFAOYSA-N
XLogP0.92
TPSA83.80 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 50.92
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

4,5,6,7-tetrahydro-1H-indazole-3-carbohydrazide
CID 2202791
5-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1H-indazole-3-carbohydrazide
CID 2874138
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
5-(2-methylbutan-2-yl)-N-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide
CID 25161475
2,2,6,6-tetramethyl-4-(2-(4,5,6,7-tetrahydro-1H-indazole-3-carbonyl)hydrazono)piperidinium
CID 801131
N-(cyclopropylmethyl)-5-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide
CID 25161457
5-(2-methylbutan-2-yl)-N-propyl-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide
CID 25163410
4,5,6,7-tetrahydro-1H-indazole-3-carboxamide
CID 28358792
4,5,6,7-tetrahydro-1H-indazole-3-carbaldehyde
CID 28808664
N'-cyclohexylidene-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-3-carbohydrazide
CID 820016
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 5-propyl-4,5,6,7-tetrahydro-1H-indazole-3-carbohydrazide?
The IUPAC name of 5-propyl-4,5,6,7-tetrahydro-1H-indazole-3-carbohydrazide (CID 25163411) is 5-propyl-4,5,6,7-tetrahydro-1H-indazole-3-carbohydrazide.
What is the SMILES notation for 5-propyl-4,5,6,7-tetrahydro-1H-indazole-3-carbohydrazide?
The canonical SMILES for 5-propyl-4,5,6,7-tetrahydro-1H-indazole-3-carbohydrazide is CCCC1CCc2[nH]nc(C(=O)NN)c2C1.
What is the InChIKey of 5-propyl-4,5,6,7-tetrahydro-1H-indazole-3-carbohydrazide?
The InChIKey is WRCCTRXGCPABER-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O/c1-2-3-7-4-5-9-8(6-7)10(15-14-9)11(16)13-12/h7H,2-6,12H2,1H3,(H,13,16)(H,14,15).
What are the key properties of 5-propyl-4,5,6,7-tetrahydro-1H-indazole-3-carbohydrazide?
5-propyl-4,5,6,7-tetrahydro-1H-indazole-3-carbohydrazide has a molecular weight of 222.29 g/mol, XLogP of 0.92, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-propyl-4,5,6,7-tetrahydro-1H-indazole-3-carbohydrazide is sourced from PubChem (CID 25163411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).