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

C14H22N4O — CID 25161469

IUPAC5-cyclohexyl-4,5,6,7-tetrahydro-1H-indazole-3-carbohydrazide
SMILESNNC(=O)c1n[nH]c2c1CC(C1CCCCC1)CC2
InChIInChI=1S/C14H22N4O/c15-16-14(19)13-11-8-10(6-7-12(11)17-18-13)9-4-2-1-3-5-9/h9-10H,1-8,15H2,(H,16,19)(H,17,18)
InChIKeyLOHQDTIZANEYAN-UHFFFAOYSA-N
MW262.36 g/mol
LogP1.70
Rot. Bonds2

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

5-cyclohexyl-4,5,6,7-tetrahydro-1H-indazole-3-carbohydrazide (PubChem CID 25161469) has the molecular formula C14H22N4O and a molecular weight of 262.36 g/mol. Its IUPAC name is 5-cyclohexyl-4,5,6,7-tetrahydro-1H-indazole-3-carbohydrazide.

Molecular Properties

Compound Name5-cyclohexyl-4,5,6,7-tetrahydro-1H-indazole-3-carbohydrazide
PubChem CID25161469
Molecular FormulaC14H22N4O
Molecular Weight262.36 g/mol
Exact Mass262.18
IUPAC Name5-cyclohexyl-4,5,6,7-tetrahydro-1H-indazole-3-carbohydrazide
SMILESNNC(=O)c1n[nH]c2c1CC(C1CCCCC1)CC2
InChIInChI=1S/C14H22N4O/c15-16-14(19)13-11-8-10(6-7-12(11)17-18-13)9-4-2-1-3-5-9/h9-10H,1-8,15H2,(H,16,19)(H,17,18)
InChIKeyLOHQDTIZANEYAN-UHFFFAOYSA-N
XLogP1.70
TPSA83.80 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 51.70
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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Frequently Asked Questions

What is the IUPAC name of 5-cyclohexyl-4,5,6,7-tetrahydro-1H-indazole-3-carbohydrazide?
The IUPAC name of 5-cyclohexyl-4,5,6,7-tetrahydro-1H-indazole-3-carbohydrazide (CID 25161469) is 5-cyclohexyl-4,5,6,7-tetrahydro-1H-indazole-3-carbohydrazide.
What is the SMILES notation for 5-cyclohexyl-4,5,6,7-tetrahydro-1H-indazole-3-carbohydrazide?
The canonical SMILES for 5-cyclohexyl-4,5,6,7-tetrahydro-1H-indazole-3-carbohydrazide is NNC(=O)c1n[nH]c2c1CC(C1CCCCC1)CC2.
What is the InChIKey of 5-cyclohexyl-4,5,6,7-tetrahydro-1H-indazole-3-carbohydrazide?
The InChIKey is LOHQDTIZANEYAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O/c15-16-14(19)13-11-8-10(6-7-12(11)17-18-13)9-4-2-1-3-5-9/h9-10H,1-8,15H2,(H,16,19)(H,17,18).
What are the key properties of 5-cyclohexyl-4,5,6,7-tetrahydro-1H-indazole-3-carbohydrazide?
5-cyclohexyl-4,5,6,7-tetrahydro-1H-indazole-3-carbohydrazide has a molecular weight of 262.36 g/mol, XLogP of 1.70, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclohexyl-4,5,6,7-tetrahydro-1H-indazole-3-carbohydrazide is sourced from PubChem (CID 25161469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).