[1-cyclopentyl-4-(2,2,2-trifluoroethoxy)butan-2-yl]hydrazine

C11H21F3N2O — CID 103151504

IUPAC[1-cyclopentyl-4-(2,2,2-trifluoroethoxy)butan-2-yl]hydrazine
SMILESNNC(CCOCC(F)(F)F)CC1CCCC1
InChIInChI=1S/C11H21F3N2O/c12-11(13,14)8-17-6-5-10(16-15)7-9-3-1-2-4-9/h9-10,16H,1-8,15H2
InChIKeyABJQAEBNDSQBBK-UHFFFAOYSA-N
MW254.30 g/mol
LogP2.37
Rot. Bonds7

About [1-cyclopentyl-4-(2,2,2-trifluoroethoxy)butan-2-yl]hydrazine

[1-cyclopentyl-4-(2,2,2-trifluoroethoxy)butan-2-yl]hydrazine (PubChem CID 103151504) has the molecular formula C11H21F3N2O and a molecular weight of 254.30 g/mol. Its IUPAC name is [1-cyclopentyl-4-(2,2,2-trifluoroethoxy)butan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-cyclopentyl-4-(2,2,2-trifluoroethoxy)butan-2-yl]hydrazine
PubChem CID103151504
Molecular FormulaC11H21F3N2O
Molecular Weight254.30 g/mol
Exact Mass254.16
IUPAC Name[1-cyclopentyl-4-(2,2,2-trifluoroethoxy)butan-2-yl]hydrazine
SMILESNNC(CCOCC(F)(F)F)CC1CCCC1
InChIInChI=1S/C11H21F3N2O/c12-11(13,14)8-17-6-5-10(16-15)7-9-3-1-2-4-9/h9-10,16H,1-8,15H2
InChIKeyABJQAEBNDSQBBK-UHFFFAOYSA-N
XLogP2.37
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.30
LogP ≤ 52.37
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-cyclopentyl-4-(2,2,2-trifluoroethoxy)butan-2-yl]hydrazine?
The IUPAC name of [1-cyclopentyl-4-(2,2,2-trifluoroethoxy)butan-2-yl]hydrazine (CID 103151504) is [1-cyclopentyl-4-(2,2,2-trifluoroethoxy)butan-2-yl]hydrazine.
What is the SMILES notation for [1-cyclopentyl-4-(2,2,2-trifluoroethoxy)butan-2-yl]hydrazine?
The canonical SMILES for [1-cyclopentyl-4-(2,2,2-trifluoroethoxy)butan-2-yl]hydrazine is NNC(CCOCC(F)(F)F)CC1CCCC1.
What is the InChIKey of [1-cyclopentyl-4-(2,2,2-trifluoroethoxy)butan-2-yl]hydrazine?
The InChIKey is ABJQAEBNDSQBBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21F3N2O/c12-11(13,14)8-17-6-5-10(16-15)7-9-3-1-2-4-9/h9-10,16H,1-8,15H2.
What are the key properties of [1-cyclopentyl-4-(2,2,2-trifluoroethoxy)butan-2-yl]hydrazine?
[1-cyclopentyl-4-(2,2,2-trifluoroethoxy)butan-2-yl]hydrazine has a molecular weight of 254.30 g/mol, XLogP of 2.37, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-cyclopentyl-4-(2,2,2-trifluoroethoxy)butan-2-yl]hydrazine is sourced from PubChem (CID 103151504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).