(1-tert-butylpiperidin-4-yl)hydrazine

C9H21N3 — CID 21097250

IUPAC(1-tert-butylpiperidin-4-yl)hydrazine
SMILESCC(C)(C)N1CCC(NN)CC1
InChIInChI=1S/C9H21N3/c1-9(2,3)12-6-4-8(11-10)5-7-12/h8,11H,4-7,10H2,1-3H3
InChIKeyVMKUVTAHFUFGLQ-UHFFFAOYSA-N
MW171.29 g/mol
LogP0.71
Rot. Bonds1

About (1-tert-butylpiperidin-4-yl)hydrazine

(1-tert-butylpiperidin-4-yl)hydrazine (PubChem CID 21097250) has the molecular formula C9H21N3 and a molecular weight of 171.29 g/mol. Its IUPAC name is (1-tert-butylpiperidin-4-yl)hydrazine.

Molecular Properties

Compound Name(1-tert-butylpiperidin-4-yl)hydrazine
PubChem CID21097250
Molecular FormulaC9H21N3
Molecular Weight171.29 g/mol
Exact Mass171.17
IUPAC Name(1-tert-butylpiperidin-4-yl)hydrazine
SMILESCC(C)(C)N1CCC(NN)CC1
InChIInChI=1S/C9H21N3/c1-9(2,3)12-6-4-8(11-10)5-7-12/h8,11H,4-7,10H2,1-3H3
InChIKeyVMKUVTAHFUFGLQ-UHFFFAOYSA-N
XLogP0.71
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.29
LogP ≤ 50.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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 (1-tert-butylpiperidin-4-yl)hydrazine?
The IUPAC name of (1-tert-butylpiperidin-4-yl)hydrazine (CID 21097250) is (1-tert-butylpiperidin-4-yl)hydrazine.
What is the SMILES notation for (1-tert-butylpiperidin-4-yl)hydrazine?
The canonical SMILES for (1-tert-butylpiperidin-4-yl)hydrazine is CC(C)(C)N1CCC(NN)CC1.
What is the InChIKey of (1-tert-butylpiperidin-4-yl)hydrazine?
The InChIKey is VMKUVTAHFUFGLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21N3/c1-9(2,3)12-6-4-8(11-10)5-7-12/h8,11H,4-7,10H2,1-3H3.
What are the key properties of (1-tert-butylpiperidin-4-yl)hydrazine?
(1-tert-butylpiperidin-4-yl)hydrazine has a molecular weight of 171.29 g/mol, XLogP of 0.71, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-tert-butylpiperidin-4-yl)hydrazine is sourced from PubChem (CID 21097250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).