3-butylheptylhydrazine

C11H26N2 — CID 142680848

IUPAC3-butylheptylhydrazine
SMILESCCCCC(CCCC)CCNN
InChIInChI=1S/C11H26N2/c1-3-5-7-11(8-6-4-2)9-10-13-12/h11,13H,3-10,12H2,1-2H3
InChIKeyHJMMDXKKDPMGGX-UHFFFAOYSA-N
MW186.34 g/mol
LogP2.84
Rot. Bonds9

About 3-butylheptylhydrazine

3-butylheptylhydrazine (PubChem CID 142680848) has the molecular formula C11H26N2 and a molecular weight of 186.34 g/mol. Its IUPAC name is 3-butylheptylhydrazine.

Molecular Properties

Compound Name3-butylheptylhydrazine
PubChem CID142680848
Molecular FormulaC11H26N2
Molecular Weight186.34 g/mol
Exact Mass186.21
IUPAC Name3-butylheptylhydrazine
SMILESCCCCC(CCCC)CCNN
InChIInChI=1S/C11H26N2/c1-3-5-7-11(8-6-4-2)9-10-13-12/h11,13H,3-10,12H2,1-2H3
InChIKeyHJMMDXKKDPMGGX-UHFFFAOYSA-N
XLogP2.84
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.34
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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 3-butylheptylhydrazine?
The IUPAC name of 3-butylheptylhydrazine (CID 142680848) is 3-butylheptylhydrazine.
What is the SMILES notation for 3-butylheptylhydrazine?
The canonical SMILES for 3-butylheptylhydrazine is CCCCC(CCCC)CCNN.
What is the InChIKey of 3-butylheptylhydrazine?
The InChIKey is HJMMDXKKDPMGGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H26N2/c1-3-5-7-11(8-6-4-2)9-10-13-12/h11,13H,3-10,12H2,1-2H3.
What are the key properties of 3-butylheptylhydrazine?
3-butylheptylhydrazine has a molecular weight of 186.34 g/mol, XLogP of 2.84, 9 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-butylheptylhydrazine is sourced from PubChem (CID 142680848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).