[5,5,5-trifluoro-1-(furan-3-yl)pentan-2-yl]hydrazine

C9H13F3N2O — CID 105248962

IUPAC[5,5,5-trifluoro-1-(furan-3-yl)pentan-2-yl]hydrazine
SMILESNNC(CCC(F)(F)F)Cc1ccoc1
InChIInChI=1S/C9H13F3N2O/c10-9(11,12)3-1-8(14-13)5-7-2-4-15-6-7/h2,4,6,8,14H,1,3,5,13H2
InChIKeyWXOHOQCWOVWRLP-UHFFFAOYSA-N
MW222.21 g/mol
LogP2.00
Rot. Bonds5

About [5,5,5-trifluoro-1-(furan-3-yl)pentan-2-yl]hydrazine

[5,5,5-trifluoro-1-(furan-3-yl)pentan-2-yl]hydrazine (PubChem CID 105248962) has the molecular formula C9H13F3N2O and a molecular weight of 222.21 g/mol. Its IUPAC name is [5,5,5-trifluoro-1-(furan-3-yl)pentan-2-yl]hydrazine.

Molecular Properties

Compound Name[5,5,5-trifluoro-1-(furan-3-yl)pentan-2-yl]hydrazine
PubChem CID105248962
Molecular FormulaC9H13F3N2O
Molecular Weight222.21 g/mol
Exact Mass222.10
IUPAC Name[5,5,5-trifluoro-1-(furan-3-yl)pentan-2-yl]hydrazine
SMILESNNC(CCC(F)(F)F)Cc1ccoc1
InChIInChI=1S/C9H13F3N2O/c10-9(11,12)3-1-8(14-13)5-7-2-4-15-6-7/h2,4,6,8,14H,1,3,5,13H2
InChIKeyWXOHOQCWOVWRLP-UHFFFAOYSA-N
XLogP2.00
TPSA51.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.21
LogP ≤ 52.00
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

[1,1,1-trifluoro-3-(furan-3-yl)propan-2-yl]hydrazine
CID 105215669
[4-(2,2-difluoroethoxy)-1-(furan-3-yl)butan-2-yl]hydrazine
CID 103151764
[1-(4-ethylphenyl)-5,5,5-trifluoropentan-2-yl]hydrazine
CID 105248876
[5,5,5-trifluoro-1-(4-methylphenyl)pentan-2-yl]hydrazine
CID 105211232
[1-(4-chlorophenyl)-3-(furan-3-yl)propan-2-yl]hydrazine
CID 105197643
[1-(furan-3-yl)-3-(4-methoxyphenyl)propan-2-yl]hydrazine
CID 105205423
[1-(furan-3-yl)-4-(3-methylphenyl)butan-2-yl]hydrazine
CID 105331898
[1-(furan-3-yl)-3-pyridin-3-ylpropan-2-yl]hydrazine
CID 105212117
[1-(furan-3-yl)-5-methoxy-4-methylpentan-2-yl]hydrazine
CID 105331884
1-(furan-3-yl)-N-methyl-3-(2,2,2-trifluoroethoxy)propan-2-amine
CID 103216126
[6,6,6-trifluoro-1-(4-methylphenyl)hexan-2-yl]hydrazine
CID 105211311
[1-(5-ethylthiophen-2-yl)-5,5,5-trifluoropentan-2-yl]hydrazine
CID 105249000

Frequently Asked Questions

What is the IUPAC name of [5,5,5-trifluoro-1-(furan-3-yl)pentan-2-yl]hydrazine?
The IUPAC name of [5,5,5-trifluoro-1-(furan-3-yl)pentan-2-yl]hydrazine (CID 105248962) is [5,5,5-trifluoro-1-(furan-3-yl)pentan-2-yl]hydrazine.
What is the SMILES notation for [5,5,5-trifluoro-1-(furan-3-yl)pentan-2-yl]hydrazine?
The canonical SMILES for [5,5,5-trifluoro-1-(furan-3-yl)pentan-2-yl]hydrazine is NNC(CCC(F)(F)F)Cc1ccoc1.
What is the InChIKey of [5,5,5-trifluoro-1-(furan-3-yl)pentan-2-yl]hydrazine?
The InChIKey is WXOHOQCWOVWRLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13F3N2O/c10-9(11,12)3-1-8(14-13)5-7-2-4-15-6-7/h2,4,6,8,14H,1,3,5,13H2.
What are the key properties of [5,5,5-trifluoro-1-(furan-3-yl)pentan-2-yl]hydrazine?
[5,5,5-trifluoro-1-(furan-3-yl)pentan-2-yl]hydrazine has a molecular weight of 222.21 g/mol, XLogP of 2.00, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5,5,5-trifluoro-1-(furan-3-yl)pentan-2-yl]hydrazine is sourced from PubChem (CID 105248962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).