[1-(6-bicyclo[3.1.0]hexanyl)-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]hydrazine

C16H28N4 — CID 105313440

IUPAC[1-(6-bicyclo[3.1.0]hexanyl)-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]hydrazine
SMILESCCC(CC)n1ccc(CC(NN)C2C3CCCC32)n1
InChIInChI=1S/C16H28N4/c1-3-12(4-2)20-9-8-11(19-20)10-15(18-17)16-13-6-5-7-14(13)16/h8-9,12-16,18H,3-7,10,17H2,1-2H3
InChIKeyKMGDQCNVZUHXIL-UHFFFAOYSA-N
MW276.43 g/mol
LogP2.66
Rot. Bonds7

About [1-(6-bicyclo[3.1.0]hexanyl)-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]hydrazine

[1-(6-bicyclo[3.1.0]hexanyl)-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]hydrazine (PubChem CID 105313440) has the molecular formula C16H28N4 and a molecular weight of 276.43 g/mol. Its IUPAC name is [1-(6-bicyclo[3.1.0]hexanyl)-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(6-bicyclo[3.1.0]hexanyl)-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]hydrazine
PubChem CID105313440
Molecular FormulaC16H28N4
Molecular Weight276.43 g/mol
Exact Mass276.23
IUPAC Name[1-(6-bicyclo[3.1.0]hexanyl)-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]hydrazine
SMILESCCC(CC)n1ccc(CC(NN)C2C3CCCC32)n1
InChIInChI=1S/C16H28N4/c1-3-12(4-2)20-9-8-11(19-20)10-15(18-17)16-13-6-5-7-14(13)16/h8-9,12-16,18H,3-7,10,17H2,1-2H3
InChIKeyKMGDQCNVZUHXIL-UHFFFAOYSA-N
XLogP2.66
TPSA55.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.43
LogP ≤ 52.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

[1-cyclohexyl-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]hydrazine
CID 105201952
1-(6-bicyclo[3.1.0]hexanyl)-2-(1-pentan-3-ylpyrazol-3-yl)ethanol
CID 115807875
[1-(oxan-3-yl)-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]hydrazine
CID 105230091
[1-(6-bicyclo[3.1.0]hexanyl)-2-(1-cyclohexylpyrazol-3-yl)ethyl]hydrazine
CID 105311729
[1-cyclopentylsulfanyl-3-(1-pentan-3-ylpyrazol-3-yl)propan-2-yl]hydrazine
CID 105227639
1-cycloheptyl-3-(1-pentan-3-ylpyrazol-3-yl)propan-2-amine
CID 104991829
1-cyclohexyl-3-(1-pentan-3-ylpyrazol-3-yl)propan-2-amine
CID 104991709
[2-(1-butan-2-ylpyrazol-3-yl)-1-cyclooctylethyl]hydrazine
CID 105255154
N-methyl-2-(1-pentan-3-ylpyrazol-3-yl)-1-(thian-2-yl)ethanamine
CID 80626578
1-(6-bicyclo[3.1.0]hexanyl)-N-methyl-2-(1-methylpyrazol-3-yl)ethanamine
CID 105025251
[3-ethoxy-1-(1-pentan-3-ylpyrazol-3-yl)pentan-2-yl]hydrazine
CID 105271202
1-cyclopentylsulfanyl-N-methyl-3-(1-pentan-3-ylpyrazol-3-yl)propan-2-amine
CID 65139202

Frequently Asked Questions

What is the IUPAC name of [1-(6-bicyclo[3.1.0]hexanyl)-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]hydrazine?
The IUPAC name of [1-(6-bicyclo[3.1.0]hexanyl)-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]hydrazine (CID 105313440) is [1-(6-bicyclo[3.1.0]hexanyl)-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]hydrazine.
What is the SMILES notation for [1-(6-bicyclo[3.1.0]hexanyl)-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]hydrazine?
The canonical SMILES for [1-(6-bicyclo[3.1.0]hexanyl)-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]hydrazine is CCC(CC)n1ccc(CC(NN)C2C3CCCC32)n1.
What is the InChIKey of [1-(6-bicyclo[3.1.0]hexanyl)-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]hydrazine?
The InChIKey is KMGDQCNVZUHXIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N4/c1-3-12(4-2)20-9-8-11(19-20)10-15(18-17)16-13-6-5-7-14(13)16/h8-9,12-16,18H,3-7,10,17H2,1-2H3.
What are the key properties of [1-(6-bicyclo[3.1.0]hexanyl)-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]hydrazine?
[1-(6-bicyclo[3.1.0]hexanyl)-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]hydrazine has a molecular weight of 276.43 g/mol, XLogP of 2.66, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(6-bicyclo[3.1.0]hexanyl)-2-(1-pentan-3-ylpyrazol-3-yl)ethyl]hydrazine is sourced from PubChem (CID 105313440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).