[1-cyclopentyl-4,4,4-trifluoro-3-(trifluoromethyl)butan-2-yl]hydrazine

C10H16F6N2 — CID 103312776

IUPAC[1-cyclopentyl-4,4,4-trifluoro-3-(trifluoromethyl)butan-2-yl]hydrazine
SMILESNNC(CC1CCCC1)C(C(F)(F)F)C(F)(F)F
InChIInChI=1S/C10H16F6N2/c11-9(12,13)8(10(14,15)16)7(18-17)5-6-3-1-2-4-6/h6-8,18H,1-5,17H2
InChIKeyXWDZOPXURMEQSV-UHFFFAOYSA-N
MW278.24 g/mol
LogP3.14
Rot. Bonds4

About [1-cyclopentyl-4,4,4-trifluoro-3-(trifluoromethyl)butan-2-yl]hydrazine

[1-cyclopentyl-4,4,4-trifluoro-3-(trifluoromethyl)butan-2-yl]hydrazine (PubChem CID 103312776) has the molecular formula C10H16F6N2 and a molecular weight of 278.24 g/mol. Its IUPAC name is [1-cyclopentyl-4,4,4-trifluoro-3-(trifluoromethyl)butan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-cyclopentyl-4,4,4-trifluoro-3-(trifluoromethyl)butan-2-yl]hydrazine
PubChem CID103312776
Molecular FormulaC10H16F6N2
Molecular Weight278.24 g/mol
Exact Mass278.12
IUPAC Name[1-cyclopentyl-4,4,4-trifluoro-3-(trifluoromethyl)butan-2-yl]hydrazine
SMILESNNC(CC1CCCC1)C(C(F)(F)F)C(F)(F)F
InChIInChI=1S/C10H16F6N2/c11-9(12,13)8(10(14,15)16)7(18-17)5-6-3-1-2-4-6/h6-8,18H,1-5,17H2
InChIKeyXWDZOPXURMEQSV-UHFFFAOYSA-N
XLogP3.14
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.24
LogP ≤ 53.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'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-cyclopentyl-4,4,4-trifluoro-3-(trifluoromethyl)butan-2-yl]hydrazine?
The IUPAC name of [1-cyclopentyl-4,4,4-trifluoro-3-(trifluoromethyl)butan-2-yl]hydrazine (CID 103312776) is [1-cyclopentyl-4,4,4-trifluoro-3-(trifluoromethyl)butan-2-yl]hydrazine.
What is the SMILES notation for [1-cyclopentyl-4,4,4-trifluoro-3-(trifluoromethyl)butan-2-yl]hydrazine?
The canonical SMILES for [1-cyclopentyl-4,4,4-trifluoro-3-(trifluoromethyl)butan-2-yl]hydrazine is NNC(CC1CCCC1)C(C(F)(F)F)C(F)(F)F.
What is the InChIKey of [1-cyclopentyl-4,4,4-trifluoro-3-(trifluoromethyl)butan-2-yl]hydrazine?
The InChIKey is XWDZOPXURMEQSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16F6N2/c11-9(12,13)8(10(14,15)16)7(18-17)5-6-3-1-2-4-6/h6-8,18H,1-5,17H2.
What are the key properties of [1-cyclopentyl-4,4,4-trifluoro-3-(trifluoromethyl)butan-2-yl]hydrazine?
[1-cyclopentyl-4,4,4-trifluoro-3-(trifluoromethyl)butan-2-yl]hydrazine has a molecular weight of 278.24 g/mol, XLogP of 3.14, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-cyclopentyl-4,4,4-trifluoro-3-(trifluoromethyl)butan-2-yl]hydrazine is sourced from PubChem (CID 103312776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).