1-(oxan-4-yl)butylhydrazine

C9H20N2O — CID 105202085

IUPAC1-(oxan-4-yl)butylhydrazine
SMILESCCCC(NN)C1CCOCC1
InChIInChI=1S/C9H20N2O/c1-2-3-9(11-10)8-4-6-12-7-5-8/h8-9,11H,2-7,10H2,1H3
InChIKeyZMOYQIXPSRJFHM-UHFFFAOYSA-N
MW172.27 g/mol
LogP1.04
Rot. Bonds4

About 1-(oxan-4-yl)butylhydrazine

1-(oxan-4-yl)butylhydrazine (PubChem CID 105202085) has the molecular formula C9H20N2O and a molecular weight of 172.27 g/mol. Its IUPAC name is 1-(oxan-4-yl)butylhydrazine.

Molecular Properties

Compound Name1-(oxan-4-yl)butylhydrazine
PubChem CID105202085
Molecular FormulaC9H20N2O
Molecular Weight172.27 g/mol
Exact Mass172.16
IUPAC Name1-(oxan-4-yl)butylhydrazine
SMILESCCCC(NN)C1CCOCC1
InChIInChI=1S/C9H20N2O/c1-2-3-9(11-10)8-4-6-12-7-5-8/h8-9,11H,2-7,10H2,1H3
InChIKeyZMOYQIXPSRJFHM-UHFFFAOYSA-N
XLogP1.04
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 51.04
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-(Oxan-4-yl)ethyl)hydrazine dihydrochloride
CID 132353842
[3,3,3-Trifluoro-1-(oxan-4-yl)propyl]hydrazine
CID 105205943
[4,4,4-Trifluoro-1-(oxan-4-yl)butyl]hydrazine
CID 105229546
[5,5,5-Trifluoro-1-(oxan-4-yl)pentyl]hydrazine
CID 105229630
(1,1,1-Trifluoro-7-methoxy-5-methylheptan-4-yl)hydrazine
CID 105248888
[2,2-Difluoro-1-(oxan-4-yl)propyl]hydrazine
CID 130708683
[(2S)-1-(oxan-3-yl)propan-2-yl]hydrazine
CID 68857420
1-(Oxan-4-yl)propan-2-ylhydrazine
CID 69401653
[2,11-Dimethyl-1-(2-methylbutoxy)dodecan-4-yl]hydrazine
CID 90896178
[1-(Oxan-4-yl)ethyl]hydrazine
CID 121603672
1-(Oxan-4-ylmethyl)-2-propylhydrazine
CID 135225566
1-Methyl-2-[1-(oxan-4-yl)ethyl]hydrazine
CID 142345451

Frequently Asked Questions

What is the IUPAC name of 1-(oxan-4-yl)butylhydrazine?
The IUPAC name of 1-(oxan-4-yl)butylhydrazine (CID 105202085) is 1-(oxan-4-yl)butylhydrazine.
What is the SMILES notation for 1-(oxan-4-yl)butylhydrazine?
The canonical SMILES for 1-(oxan-4-yl)butylhydrazine is CCCC(NN)C1CCOCC1.
What is the InChIKey of 1-(oxan-4-yl)butylhydrazine?
The InChIKey is ZMOYQIXPSRJFHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O/c1-2-3-9(11-10)8-4-6-12-7-5-8/h8-9,11H,2-7,10H2,1H3.
What are the key properties of 1-(oxan-4-yl)butylhydrazine?
1-(oxan-4-yl)butylhydrazine has a molecular weight of 172.27 g/mol, XLogP of 1.04, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(oxan-4-yl)butylhydrazine is sourced from PubChem (CID 105202085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).