[4-methyl-1-(oxolan-2-yl)heptan-3-yl]hydrazine

C12H26N2O — CID 105314328

IUPAC[4-methyl-1-(oxolan-2-yl)heptan-3-yl]hydrazine
SMILESCCCC(C)C(CCC1CCCO1)NN
InChIInChI=1S/C12H26N2O/c1-3-5-10(2)12(14-13)8-7-11-6-4-9-15-11/h10-12,14H,3-9,13H2,1-2H3
InChIKeyTXPXXSRARYWIFC-UHFFFAOYSA-N
MW214.35 g/mol
LogP2.21
Rot. Bonds7

About [4-methyl-1-(oxolan-2-yl)heptan-3-yl]hydrazine

[4-methyl-1-(oxolan-2-yl)heptan-3-yl]hydrazine (PubChem CID 105314328) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is [4-methyl-1-(oxolan-2-yl)heptan-3-yl]hydrazine.

Molecular Properties

Compound Name[4-methyl-1-(oxolan-2-yl)heptan-3-yl]hydrazine
PubChem CID105314328
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC Name[4-methyl-1-(oxolan-2-yl)heptan-3-yl]hydrazine
SMILESCCCC(C)C(CCC1CCCO1)NN
InChIInChI=1S/C12H26N2O/c1-3-5-10(2)12(14-13)8-7-11-6-4-9-15-11/h10-12,14H,3-9,13H2,1-2H3
InChIKeyTXPXXSRARYWIFC-UHFFFAOYSA-N
XLogP2.21
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 52.21
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 [4-methyl-1-(oxolan-2-yl)heptan-3-yl]hydrazine?
The IUPAC name of [4-methyl-1-(oxolan-2-yl)heptan-3-yl]hydrazine (CID 105314328) is [4-methyl-1-(oxolan-2-yl)heptan-3-yl]hydrazine.
What is the SMILES notation for [4-methyl-1-(oxolan-2-yl)heptan-3-yl]hydrazine?
The canonical SMILES for [4-methyl-1-(oxolan-2-yl)heptan-3-yl]hydrazine is CCCC(C)C(CCC1CCCO1)NN.
What is the InChIKey of [4-methyl-1-(oxolan-2-yl)heptan-3-yl]hydrazine?
The InChIKey is TXPXXSRARYWIFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-3-5-10(2)12(14-13)8-7-11-6-4-9-15-11/h10-12,14H,3-9,13H2,1-2H3.
What are the key properties of [4-methyl-1-(oxolan-2-yl)heptan-3-yl]hydrazine?
[4-methyl-1-(oxolan-2-yl)heptan-3-yl]hydrazine has a molecular weight of 214.35 g/mol, XLogP of 2.21, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-methyl-1-(oxolan-2-yl)heptan-3-yl]hydrazine is sourced from PubChem (CID 105314328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).