[1-(cyclohexen-1-yl)-3-(2-methyltetrazol-5-yl)propan-2-yl]hydrazine

C11H20N6 — CID 107066404

IUPAC[1-(cyclohexen-1-yl)-3-(2-methyltetrazol-5-yl)propan-2-yl]hydrazine
SMILESCn1nnc(CC(CC2=CCCCC2)NN)n1
InChIInChI=1S/C11H20N6/c1-17-15-11(14-16-17)8-10(13-12)7-9-5-3-2-4-6-9/h5,10,13H,2-4,6-8,12H2,1H3
InChIKeyBBLDKOLFTNIKAA-UHFFFAOYSA-N
MW236.32 g/mol
LogP0.47
Rot. Bonds5

About [1-(cyclohexen-1-yl)-3-(2-methyltetrazol-5-yl)propan-2-yl]hydrazine

[1-(cyclohexen-1-yl)-3-(2-methyltetrazol-5-yl)propan-2-yl]hydrazine (PubChem CID 107066404) has the molecular formula C11H20N6 and a molecular weight of 236.32 g/mol. Its IUPAC name is [1-(cyclohexen-1-yl)-3-(2-methyltetrazol-5-yl)propan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(cyclohexen-1-yl)-3-(2-methyltetrazol-5-yl)propan-2-yl]hydrazine
PubChem CID107066404
Molecular FormulaC11H20N6
Molecular Weight236.32 g/mol
Exact Mass236.17
IUPAC Name[1-(cyclohexen-1-yl)-3-(2-methyltetrazol-5-yl)propan-2-yl]hydrazine
SMILESCn1nnc(CC(CC2=CCCCC2)NN)n1
InChIInChI=1S/C11H20N6/c1-17-15-11(14-16-17)8-10(13-12)7-9-5-3-2-4-6-9/h5,10,13H,2-4,6-8,12H2,1H3
InChIKeyBBLDKOLFTNIKAA-UHFFFAOYSA-N
XLogP0.47
TPSA81.65 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 50.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', '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 [1-(cyclohexen-1-yl)-3-(2-methyltetrazol-5-yl)propan-2-yl]hydrazine?
The IUPAC name of [1-(cyclohexen-1-yl)-3-(2-methyltetrazol-5-yl)propan-2-yl]hydrazine (CID 107066404) is [1-(cyclohexen-1-yl)-3-(2-methyltetrazol-5-yl)propan-2-yl]hydrazine.
What is the SMILES notation for [1-(cyclohexen-1-yl)-3-(2-methyltetrazol-5-yl)propan-2-yl]hydrazine?
The canonical SMILES for [1-(cyclohexen-1-yl)-3-(2-methyltetrazol-5-yl)propan-2-yl]hydrazine is Cn1nnc(CC(CC2=CCCCC2)NN)n1.
What is the InChIKey of [1-(cyclohexen-1-yl)-3-(2-methyltetrazol-5-yl)propan-2-yl]hydrazine?
The InChIKey is BBLDKOLFTNIKAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N6/c1-17-15-11(14-16-17)8-10(13-12)7-9-5-3-2-4-6-9/h5,10,13H,2-4,6-8,12H2,1H3.
What are the key properties of [1-(cyclohexen-1-yl)-3-(2-methyltetrazol-5-yl)propan-2-yl]hydrazine?
[1-(cyclohexen-1-yl)-3-(2-methyltetrazol-5-yl)propan-2-yl]hydrazine has a molecular weight of 236.32 g/mol, XLogP of 0.47, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(cyclohexen-1-yl)-3-(2-methyltetrazol-5-yl)propan-2-yl]hydrazine is sourced from PubChem (CID 107066404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).