[1-(2,2-difluoroethoxy)-5-methylideneheptan-3-yl]hydrazine

C10H20F2N2O — CID 103151798

IUPAC[1-(2,2-difluoroethoxy)-5-methylideneheptan-3-yl]hydrazine
SMILESC=C(CC)CC(CCOCC(F)F)NN
InChIInChI=1S/C10H20F2N2O/c1-3-8(2)6-9(14-13)4-5-15-7-10(11)12/h9-10,14H,2-7,13H2,1H3
InChIKeyPIWPDWHIBDMMRT-UHFFFAOYSA-N
MW222.28 g/mol
LogP1.85
Rot. Bonds9

About [1-(2,2-difluoroethoxy)-5-methylideneheptan-3-yl]hydrazine

[1-(2,2-difluoroethoxy)-5-methylideneheptan-3-yl]hydrazine (PubChem CID 103151798) has the molecular formula C10H20F2N2O and a molecular weight of 222.28 g/mol. Its IUPAC name is [1-(2,2-difluoroethoxy)-5-methylideneheptan-3-yl]hydrazine.

Molecular Properties

Compound Name[1-(2,2-difluoroethoxy)-5-methylideneheptan-3-yl]hydrazine
PubChem CID103151798
Molecular FormulaC10H20F2N2O
Molecular Weight222.28 g/mol
Exact Mass222.15
IUPAC Name[1-(2,2-difluoroethoxy)-5-methylideneheptan-3-yl]hydrazine
SMILESC=C(CC)CC(CCOCC(F)F)NN
InChIInChI=1S/C10H20F2N2O/c1-3-8(2)6-9(14-13)4-5-15-7-10(11)12/h9-10,14H,2-7,13H2,1H3
InChIKeyPIWPDWHIBDMMRT-UHFFFAOYSA-N
XLogP1.85
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.28
LogP ≤ 51.85
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': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

5-Methylidene-1-(2,2,2-trifluoroethoxy)heptan-3-amine
CID 103148073
6-Methyl-1-(2,2,2-trifluoroethoxy)hept-6-en-3-amine
CID 103148112
1-(2,2-Difluoroethoxy)-5-methylideneheptan-3-amine
CID 103148956
1-(2,2-Difluoroethoxy)-6-methylhept-6-en-3-amine
CID 103149006
[6-Methyl-1-(2,2,2-trifluoroethoxy)hept-6-en-3-yl]hydrazine
CID 103151449
[5-Methylidene-1-(2,2,2-trifluoroethoxy)heptan-3-yl]hydrazine
CID 103151481
[2-Methyl-5-(2,2,2-trifluoroethoxy)pent-1-en-3-yl]hydrazine
CID 103151550
1-(2,2,2-Trifluoroethoxy)oct-7-en-3-ylhydrazine
CID 103151682
1-(2,2,2-Trifluoroethoxy)hept-6-en-3-ylhydrazine
CID 103151688
[1-(3,4-dihydro-2H-pyran-5-yl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine
CID 103151719
[5-Methyl-1-(2,2,2-trifluoroethoxy)hex-5-en-3-yl]hydrazine
CID 103151729
[1-(2,2-Difluoroethoxy)-6-methylhept-6-en-3-yl]hydrazine
CID 103151769

Frequently Asked Questions

What is the IUPAC name of [1-(2,2-difluoroethoxy)-5-methylideneheptan-3-yl]hydrazine?
The IUPAC name of [1-(2,2-difluoroethoxy)-5-methylideneheptan-3-yl]hydrazine (CID 103151798) is [1-(2,2-difluoroethoxy)-5-methylideneheptan-3-yl]hydrazine.
What is the SMILES notation for [1-(2,2-difluoroethoxy)-5-methylideneheptan-3-yl]hydrazine?
The canonical SMILES for [1-(2,2-difluoroethoxy)-5-methylideneheptan-3-yl]hydrazine is C=C(CC)CC(CCOCC(F)F)NN.
What is the InChIKey of [1-(2,2-difluoroethoxy)-5-methylideneheptan-3-yl]hydrazine?
The InChIKey is PIWPDWHIBDMMRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20F2N2O/c1-3-8(2)6-9(14-13)4-5-15-7-10(11)12/h9-10,14H,2-7,13H2,1H3.
What are the key properties of [1-(2,2-difluoroethoxy)-5-methylideneheptan-3-yl]hydrazine?
[1-(2,2-difluoroethoxy)-5-methylideneheptan-3-yl]hydrazine has a molecular weight of 222.28 g/mol, XLogP of 1.85, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,2-difluoroethoxy)-5-methylideneheptan-3-yl]hydrazine is sourced from PubChem (CID 103151798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).