[3-(2,2-difluoroethoxy)-1-(1,9-dioxaspiro[5.5]undecan-4-yl)propyl]hydrazine

C14H26F2N2O3 — CID 103152084

IUPAC[3-(2,2-difluoroethoxy)-1-(1,9-dioxaspiro[5.5]undecan-4-yl)propyl]hydrazine
SMILESNNC(CCOCC(F)F)C1CCOC2(CCOCC2)C1
InChIInChI=1S/C14H26F2N2O3/c15-13(16)10-20-5-2-12(18-17)11-1-6-21-14(9-11)3-7-19-8-4-14/h11-13,18H,1-10,17H2
InChIKeyUEDWFLPHHXOYCV-UHFFFAOYSA-N
MW308.37 g/mol
LogP1.47
Rot. Bonds7

About [3-(2,2-difluoroethoxy)-1-(1,9-dioxaspiro[5.5]undecan-4-yl)propyl]hydrazine

[3-(2,2-difluoroethoxy)-1-(1,9-dioxaspiro[5.5]undecan-4-yl)propyl]hydrazine (PubChem CID 103152084) has the molecular formula C14H26F2N2O3 and a molecular weight of 308.37 g/mol. Its IUPAC name is [3-(2,2-difluoroethoxy)-1-(1,9-dioxaspiro[5.5]undecan-4-yl)propyl]hydrazine.

Molecular Properties

Compound Name[3-(2,2-difluoroethoxy)-1-(1,9-dioxaspiro[5.5]undecan-4-yl)propyl]hydrazine
PubChem CID103152084
Molecular FormulaC14H26F2N2O3
Molecular Weight308.37 g/mol
Exact Mass308.19
IUPAC Name[3-(2,2-difluoroethoxy)-1-(1,9-dioxaspiro[5.5]undecan-4-yl)propyl]hydrazine
SMILESNNC(CCOCC(F)F)C1CCOC2(CCOCC2)C1
InChIInChI=1S/C14H26F2N2O3/c15-13(16)10-20-5-2-12(18-17)11-1-6-21-14(9-11)3-7-19-8-4-14/h11-13,18H,1-10,17H2
InChIKeyUEDWFLPHHXOYCV-UHFFFAOYSA-N
XLogP1.47
TPSA65.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.37
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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 [3-(2,2-difluoroethoxy)-1-(1,9-dioxaspiro[5.5]undecan-4-yl)propyl]hydrazine?
The IUPAC name of [3-(2,2-difluoroethoxy)-1-(1,9-dioxaspiro[5.5]undecan-4-yl)propyl]hydrazine (CID 103152084) is [3-(2,2-difluoroethoxy)-1-(1,9-dioxaspiro[5.5]undecan-4-yl)propyl]hydrazine.
What is the SMILES notation for [3-(2,2-difluoroethoxy)-1-(1,9-dioxaspiro[5.5]undecan-4-yl)propyl]hydrazine?
The canonical SMILES for [3-(2,2-difluoroethoxy)-1-(1,9-dioxaspiro[5.5]undecan-4-yl)propyl]hydrazine is NNC(CCOCC(F)F)C1CCOC2(CCOCC2)C1.
What is the InChIKey of [3-(2,2-difluoroethoxy)-1-(1,9-dioxaspiro[5.5]undecan-4-yl)propyl]hydrazine?
The InChIKey is UEDWFLPHHXOYCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26F2N2O3/c15-13(16)10-20-5-2-12(18-17)11-1-6-21-14(9-11)3-7-19-8-4-14/h11-13,18H,1-10,17H2.
What are the key properties of [3-(2,2-difluoroethoxy)-1-(1,9-dioxaspiro[5.5]undecan-4-yl)propyl]hydrazine?
[3-(2,2-difluoroethoxy)-1-(1,9-dioxaspiro[5.5]undecan-4-yl)propyl]hydrazine has a molecular weight of 308.37 g/mol, XLogP of 1.47, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(2,2-difluoroethoxy)-1-(1,9-dioxaspiro[5.5]undecan-4-yl)propyl]hydrazine is sourced from PubChem (CID 103152084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).