[1-cyclobutyl-3-(2,2-difluoroethoxy)propyl]hydrazine

C9H18F2N2O — CID 103151818

IUPAC[1-cyclobutyl-3-(2,2-difluoroethoxy)propyl]hydrazine
SMILESNNC(CCOCC(F)F)C1CCC1
InChIInChI=1S/C9H18F2N2O/c10-9(11)6-14-5-4-8(13-12)7-2-1-3-7/h7-9,13H,1-6,12H2
InChIKeyWSQWVWCTQPZDGR-UHFFFAOYSA-N
MW208.25 g/mol
LogP1.29
Rot. Bonds7

About [1-cyclobutyl-3-(2,2-difluoroethoxy)propyl]hydrazine

[1-cyclobutyl-3-(2,2-difluoroethoxy)propyl]hydrazine (PubChem CID 103151818) has the molecular formula C9H18F2N2O and a molecular weight of 208.25 g/mol. Its IUPAC name is [1-cyclobutyl-3-(2,2-difluoroethoxy)propyl]hydrazine.

Molecular Properties

Compound Name[1-cyclobutyl-3-(2,2-difluoroethoxy)propyl]hydrazine
PubChem CID103151818
Molecular FormulaC9H18F2N2O
Molecular Weight208.25 g/mol
Exact Mass208.14
IUPAC Name[1-cyclobutyl-3-(2,2-difluoroethoxy)propyl]hydrazine
SMILESNNC(CCOCC(F)F)C1CCC1
InChIInChI=1S/C9H18F2N2O/c10-9(11)6-14-5-4-8(13-12)7-2-1-3-7/h7-9,13H,1-6,12H2
InChIKeyWSQWVWCTQPZDGR-UHFFFAOYSA-N
XLogP1.29
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.25
LogP ≤ 51.29
H-Bond Donors ≤ 52
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 [1-cyclobutyl-3-(2,2-difluoroethoxy)propyl]hydrazine?
The IUPAC name of [1-cyclobutyl-3-(2,2-difluoroethoxy)propyl]hydrazine (CID 103151818) is [1-cyclobutyl-3-(2,2-difluoroethoxy)propyl]hydrazine.
What is the SMILES notation for [1-cyclobutyl-3-(2,2-difluoroethoxy)propyl]hydrazine?
The canonical SMILES for [1-cyclobutyl-3-(2,2-difluoroethoxy)propyl]hydrazine is NNC(CCOCC(F)F)C1CCC1.
What is the InChIKey of [1-cyclobutyl-3-(2,2-difluoroethoxy)propyl]hydrazine?
The InChIKey is WSQWVWCTQPZDGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18F2N2O/c10-9(11)6-14-5-4-8(13-12)7-2-1-3-7/h7-9,13H,1-6,12H2.
What are the key properties of [1-cyclobutyl-3-(2,2-difluoroethoxy)propyl]hydrazine?
[1-cyclobutyl-3-(2,2-difluoroethoxy)propyl]hydrazine has a molecular weight of 208.25 g/mol, XLogP of 1.29, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-cyclobutyl-3-(2,2-difluoroethoxy)propyl]hydrazine is sourced from PubChem (CID 103151818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).