[6-(2-methylbutan-2-yl)-5,6,7,8-tetrahydrocinnolin-3-yl]hydrazine

C13H22N4 — CID 62784054

IUPAC[6-(2-methylbutan-2-yl)-5,6,7,8-tetrahydrocinnolin-3-yl]hydrazine
SMILESCCC(C)(C)C1CCc2nnc(NN)cc2C1
InChIInChI=1S/C13H22N4/c1-4-13(2,3)10-5-6-11-9(7-10)8-12(15-14)17-16-11/h8,10H,4-7,14H2,1-3H3,(H,15,17)
InChIKeyNCQFPFLJEGWYBQ-UHFFFAOYSA-N
MW234.35 g/mol
LogP2.30
Rot. Bonds3

About [6-(2-methylbutan-2-yl)-5,6,7,8-tetrahydrocinnolin-3-yl]hydrazine

[6-(2-methylbutan-2-yl)-5,6,7,8-tetrahydrocinnolin-3-yl]hydrazine (PubChem CID 62784054) has the molecular formula C13H22N4 and a molecular weight of 234.35 g/mol. Its IUPAC name is [6-(2-methylbutan-2-yl)-5,6,7,8-tetrahydrocinnolin-3-yl]hydrazine.

Molecular Properties

Compound Name[6-(2-methylbutan-2-yl)-5,6,7,8-tetrahydrocinnolin-3-yl]hydrazine
PubChem CID62784054
Molecular FormulaC13H22N4
Molecular Weight234.35 g/mol
Exact Mass234.18
IUPAC Name[6-(2-methylbutan-2-yl)-5,6,7,8-tetrahydrocinnolin-3-yl]hydrazine
SMILESCCC(C)(C)C1CCc2nnc(NN)cc2C1
InChIInChI=1S/C13H22N4/c1-4-13(2,3)10-5-6-11-9(7-10)8-12(15-14)17-16-11/h8,10H,4-7,14H2,1-3H3,(H,15,17)
InChIKeyNCQFPFLJEGWYBQ-UHFFFAOYSA-N
XLogP2.30
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.35
LogP ≤ 52.30
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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Frequently Asked Questions

What is the IUPAC name of [6-(2-methylbutan-2-yl)-5,6,7,8-tetrahydrocinnolin-3-yl]hydrazine?
The IUPAC name of [6-(2-methylbutan-2-yl)-5,6,7,8-tetrahydrocinnolin-3-yl]hydrazine (CID 62784054) is [6-(2-methylbutan-2-yl)-5,6,7,8-tetrahydrocinnolin-3-yl]hydrazine.
What is the SMILES notation for [6-(2-methylbutan-2-yl)-5,6,7,8-tetrahydrocinnolin-3-yl]hydrazine?
The canonical SMILES for [6-(2-methylbutan-2-yl)-5,6,7,8-tetrahydrocinnolin-3-yl]hydrazine is CCC(C)(C)C1CCc2nnc(NN)cc2C1.
What is the InChIKey of [6-(2-methylbutan-2-yl)-5,6,7,8-tetrahydrocinnolin-3-yl]hydrazine?
The InChIKey is NCQFPFLJEGWYBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4/c1-4-13(2,3)10-5-6-11-9(7-10)8-12(15-14)17-16-11/h8,10H,4-7,14H2,1-3H3,(H,15,17).
What are the key properties of [6-(2-methylbutan-2-yl)-5,6,7,8-tetrahydrocinnolin-3-yl]hydrazine?
[6-(2-methylbutan-2-yl)-5,6,7,8-tetrahydrocinnolin-3-yl]hydrazine has a molecular weight of 234.35 g/mol, XLogP of 2.30, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(2-methylbutan-2-yl)-5,6,7,8-tetrahydrocinnolin-3-yl]hydrazine is sourced from PubChem (CID 62784054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).