[1-(2-adamantyl)-4-(oxolan-2-yl)butyl]hydrazine

C18H32N2O — CID 105314183

IUPAC[1-(2-adamantyl)-4-(oxolan-2-yl)butyl]hydrazine
SMILESNNC(CCCC1CCCO1)C1C2CC3CC(C2)CC1C3
InChIInChI=1S/C18H32N2O/c19-20-17(5-1-3-16-4-2-6-21-16)18-14-8-12-7-13(10-14)11-15(18)9-12/h12-18,20H,1-11,19H2
InChIKeyMHPFZLHCHJSAAB-UHFFFAOYSA-N
MW292.47 g/mol
LogP3.24
Rot. Bonds6

About [1-(2-adamantyl)-4-(oxolan-2-yl)butyl]hydrazine

[1-(2-adamantyl)-4-(oxolan-2-yl)butyl]hydrazine (PubChem CID 105314183) has the molecular formula C18H32N2O and a molecular weight of 292.47 g/mol. Its IUPAC name is [1-(2-adamantyl)-4-(oxolan-2-yl)butyl]hydrazine.

Molecular Properties

Compound Name[1-(2-adamantyl)-4-(oxolan-2-yl)butyl]hydrazine
PubChem CID105314183
Molecular FormulaC18H32N2O
Molecular Weight292.47 g/mol
Exact Mass292.25
IUPAC Name[1-(2-adamantyl)-4-(oxolan-2-yl)butyl]hydrazine
SMILESNNC(CCCC1CCCO1)C1C2CC3CC(C2)CC1C3
InChIInChI=1S/C18H32N2O/c19-20-17(5-1-3-16-4-2-6-21-16)18-14-8-12-7-13(10-14)11-15(18)9-12/h12-18,20H,1-11,19H2
InChIKeyMHPFZLHCHJSAAB-UHFFFAOYSA-N
XLogP3.24
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.47
LogP ≤ 53.24
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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Related Compounds

[1-(3-methyloxolan-2-yl)-4-(oxolan-2-yl)butyl]hydrazine
CID 105314175
[5-methyl-1-(oxolan-2-yl)heptan-4-yl]hydrazine
CID 105219692
1-(2-adamantyl)octylhydrazine
CID 105293660
[1,1-diethoxy-5-(oxolan-2-yl)pentan-2-yl]hydrazine
CID 105246420
[1-(3-ethyl-1,4-dithian-2-yl)-4-(oxolan-2-yl)butyl]hydrazine
CID 105259943
[1-cycloheptyl-3-(oxolan-2-yl)propyl]hydrazine
CID 105231964
1-cyclobutyl-N-methyl-4-(oxolan-2-yl)butan-1-amine
CID 65164623
[1-(oxan-4-yl)-3-(oxolan-2-yl)propyl]hydrazine
CID 105229624
[4-(oxolan-2-yl)-1-(2,4,6-trimethylphenyl)butyl]hydrazine
CID 105314099
[1-cyclopropyl-1-ethoxy-5-(oxolan-2-yl)pentan-2-yl]hydrazine
CID 105273156
N-methyl-4-(oxolan-2-yl)-1-(oxolan-3-yl)butan-1-amine
CID 65330358
[1-(2-adamantyl)-2-cyclopropylethyl]hydrazine
CID 105311163

Frequently Asked Questions

What is the IUPAC name of [1-(2-adamantyl)-4-(oxolan-2-yl)butyl]hydrazine?
The IUPAC name of [1-(2-adamantyl)-4-(oxolan-2-yl)butyl]hydrazine (CID 105314183) is [1-(2-adamantyl)-4-(oxolan-2-yl)butyl]hydrazine.
What is the SMILES notation for [1-(2-adamantyl)-4-(oxolan-2-yl)butyl]hydrazine?
The canonical SMILES for [1-(2-adamantyl)-4-(oxolan-2-yl)butyl]hydrazine is NNC(CCCC1CCCO1)C1C2CC3CC(C2)CC1C3.
What is the InChIKey of [1-(2-adamantyl)-4-(oxolan-2-yl)butyl]hydrazine?
The InChIKey is MHPFZLHCHJSAAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H32N2O/c19-20-17(5-1-3-16-4-2-6-21-16)18-14-8-12-7-13(10-14)11-15(18)9-12/h12-18,20H,1-11,19H2.
What are the key properties of [1-(2-adamantyl)-4-(oxolan-2-yl)butyl]hydrazine?
[1-(2-adamantyl)-4-(oxolan-2-yl)butyl]hydrazine has a molecular weight of 292.47 g/mol, XLogP of 3.24, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-adamantyl)-4-(oxolan-2-yl)butyl]hydrazine is sourced from PubChem (CID 105314183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).