5,6-dimethylheptan-3-ylhydrazine

C9H22N2 — CID 123908287

IUPAC5,6-dimethylheptan-3-ylhydrazine
SMILESCCC(CC(C)C(C)C)NN
InChIInChI=1S/C9H22N2/c1-5-9(11-10)6-8(4)7(2)3/h7-9,11H,5-6,10H2,1-4H3
InChIKeyRQKCBLIBDQVZIB-UHFFFAOYSA-N
MW158.29 g/mol
LogP1.91
Rot. Bonds5

About 5,6-dimethylheptan-3-ylhydrazine

5,6-dimethylheptan-3-ylhydrazine (PubChem CID 123908287) has the molecular formula C9H22N2 and a molecular weight of 158.29 g/mol. Its IUPAC name is 5,6-dimethylheptan-3-ylhydrazine.

Molecular Properties

Compound Name5,6-dimethylheptan-3-ylhydrazine
PubChem CID123908287
Molecular FormulaC9H22N2
Molecular Weight158.29 g/mol
Exact Mass158.18
IUPAC Name5,6-dimethylheptan-3-ylhydrazine
SMILESCCC(CC(C)C(C)C)NN
InChIInChI=1S/C9H22N2/c1-5-9(11-10)6-8(4)7(2)3/h7-9,11H,5-6,10H2,1-4H3
InChIKeyRQKCBLIBDQVZIB-UHFFFAOYSA-N
XLogP1.91
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.29
LogP ≤ 51.91
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 5,6-dimethylheptan-3-ylhydrazine?
The IUPAC name of 5,6-dimethylheptan-3-ylhydrazine (CID 123908287) is 5,6-dimethylheptan-3-ylhydrazine.
What is the SMILES notation for 5,6-dimethylheptan-3-ylhydrazine?
The canonical SMILES for 5,6-dimethylheptan-3-ylhydrazine is CCC(CC(C)C(C)C)NN.
What is the InChIKey of 5,6-dimethylheptan-3-ylhydrazine?
The InChIKey is RQKCBLIBDQVZIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H22N2/c1-5-9(11-10)6-8(4)7(2)3/h7-9,11H,5-6,10H2,1-4H3.
What are the key properties of 5,6-dimethylheptan-3-ylhydrazine?
5,6-dimethylheptan-3-ylhydrazine has a molecular weight of 158.29 g/mol, XLogP of 1.91, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dimethylheptan-3-ylhydrazine is sourced from PubChem (CID 123908287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).