[4,4,4-trifluoro-1-(4-propan-2-ylmorpholin-2-yl)butyl]hydrazine

C11H22F3N3O — CID 105248002

IUPAC[4,4,4-trifluoro-1-(4-propan-2-ylmorpholin-2-yl)butyl]hydrazine
SMILESCC(C)N1CCOC(C(CCC(F)(F)F)NN)C1
InChIInChI=1S/C11H22F3N3O/c1-8(2)17-5-6-18-10(7-17)9(16-15)3-4-11(12,13)14/h8-10,16H,3-7,15H2,1-2H3
InChIKeyJKCJKEDMRVZLJI-UHFFFAOYSA-N
MW269.31 g/mol
LogP1.27
Rot. Bonds5

About [4,4,4-trifluoro-1-(4-propan-2-ylmorpholin-2-yl)butyl]hydrazine

[4,4,4-trifluoro-1-(4-propan-2-ylmorpholin-2-yl)butyl]hydrazine (PubChem CID 105248002) has the molecular formula C11H22F3N3O and a molecular weight of 269.31 g/mol. Its IUPAC name is [4,4,4-trifluoro-1-(4-propan-2-ylmorpholin-2-yl)butyl]hydrazine.

Molecular Properties

Compound Name[4,4,4-trifluoro-1-(4-propan-2-ylmorpholin-2-yl)butyl]hydrazine
PubChem CID105248002
Molecular FormulaC11H22F3N3O
Molecular Weight269.31 g/mol
Exact Mass269.17
IUPAC Name[4,4,4-trifluoro-1-(4-propan-2-ylmorpholin-2-yl)butyl]hydrazine
SMILESCC(C)N1CCOC(C(CCC(F)(F)F)NN)C1
InChIInChI=1S/C11H22F3N3O/c1-8(2)17-5-6-18-10(7-17)9(16-15)3-4-11(12,13)14/h8-10,16H,3-7,15H2,1-2H3
InChIKeyJKCJKEDMRVZLJI-UHFFFAOYSA-N
XLogP1.27
TPSA50.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.31
LogP ≤ 51.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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 [4,4,4-trifluoro-1-(4-propan-2-ylmorpholin-2-yl)butyl]hydrazine?
The IUPAC name of [4,4,4-trifluoro-1-(4-propan-2-ylmorpholin-2-yl)butyl]hydrazine (CID 105248002) is [4,4,4-trifluoro-1-(4-propan-2-ylmorpholin-2-yl)butyl]hydrazine.
What is the SMILES notation for [4,4,4-trifluoro-1-(4-propan-2-ylmorpholin-2-yl)butyl]hydrazine?
The canonical SMILES for [4,4,4-trifluoro-1-(4-propan-2-ylmorpholin-2-yl)butyl]hydrazine is CC(C)N1CCOC(C(CCC(F)(F)F)NN)C1.
What is the InChIKey of [4,4,4-trifluoro-1-(4-propan-2-ylmorpholin-2-yl)butyl]hydrazine?
The InChIKey is JKCJKEDMRVZLJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22F3N3O/c1-8(2)17-5-6-18-10(7-17)9(16-15)3-4-11(12,13)14/h8-10,16H,3-7,15H2,1-2H3.
What are the key properties of [4,4,4-trifluoro-1-(4-propan-2-ylmorpholin-2-yl)butyl]hydrazine?
[4,4,4-trifluoro-1-(4-propan-2-ylmorpholin-2-yl)butyl]hydrazine has a molecular weight of 269.31 g/mol, XLogP of 1.27, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4,4,4-trifluoro-1-(4-propan-2-ylmorpholin-2-yl)butyl]hydrazine is sourced from PubChem (CID 105248002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).