heptan-1-ol;hydrazine

C7H20N2O — CID 159330416

IUPACheptan-1-ol;hydrazine
SMILESCCCCCCCO.NN
InChIInChI=1S/C7H16O.H4N2/c1-2-3-4-5-6-7-8;1-2/h8H,2-7H2,1H3;1-2H2
InChIKeyLEXBOCWJTGOJOH-UHFFFAOYSA-N
MW148.25 g/mol
LogP0.77
Rot. Bonds5

About heptan-1-ol;hydrazine

heptan-1-ol;hydrazine (PubChem CID 159330416) has the molecular formula C7H20N2O and a molecular weight of 148.25 g/mol. Its IUPAC name is heptan-1-ol;hydrazine.

Molecular Properties

Compound Nameheptan-1-ol;hydrazine
PubChem CID159330416
Molecular FormulaC7H20N2O
Molecular Weight148.25 g/mol
Exact Mass148.16
IUPAC Nameheptan-1-ol;hydrazine
SMILESCCCCCCCO.NN
InChIInChI=1S/C7H16O.H4N2/c1-2-3-4-5-6-7-8;1-2/h8H,2-7H2,1H3;1-2H2
InChIKeyLEXBOCWJTGOJOH-UHFFFAOYSA-N
XLogP0.77
TPSA72.27 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.25
LogP ≤ 50.77
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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 heptan-1-ol;hydrazine?
The IUPAC name of heptan-1-ol;hydrazine (CID 159330416) is heptan-1-ol;hydrazine.
What is the SMILES notation for heptan-1-ol;hydrazine?
The canonical SMILES for heptan-1-ol;hydrazine is CCCCCCCO.NN.
What is the InChIKey of heptan-1-ol;hydrazine?
The InChIKey is LEXBOCWJTGOJOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16O.H4N2/c1-2-3-4-5-6-7-8;1-2/h8H,2-7H2,1H3;1-2H2.
What are the key properties of heptan-1-ol;hydrazine?
heptan-1-ol;hydrazine has a molecular weight of 148.25 g/mol, XLogP of 0.77, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for heptan-1-ol;hydrazine is sourced from PubChem (CID 159330416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).