(6,6,6-trifluoro-2-methyl-2-pyrrolidin-1-ylhexan-3-yl)hydrazine

C11H22F3N3 — CID 105239467

IUPAC(6,6,6-trifluoro-2-methyl-2-pyrrolidin-1-ylhexan-3-yl)hydrazine
SMILESCC(C)(C(CCC(F)(F)F)NN)N1CCCC1
InChIInChI=1S/C11H22F3N3/c1-10(2,17-7-3-4-8-17)9(16-15)5-6-11(12,13)14/h9,16H,3-8,15H2,1-2H3
InChIKeyPOUJOVDCQKXHMM-UHFFFAOYSA-N
MW253.31 g/mol
LogP2.04
Rot. Bonds5

About (6,6,6-trifluoro-2-methyl-2-pyrrolidin-1-ylhexan-3-yl)hydrazine

(6,6,6-trifluoro-2-methyl-2-pyrrolidin-1-ylhexan-3-yl)hydrazine (PubChem CID 105239467) has the molecular formula C11H22F3N3 and a molecular weight of 253.31 g/mol. Its IUPAC name is (6,6,6-trifluoro-2-methyl-2-pyrrolidin-1-ylhexan-3-yl)hydrazine.

Molecular Properties

Compound Name(6,6,6-trifluoro-2-methyl-2-pyrrolidin-1-ylhexan-3-yl)hydrazine
PubChem CID105239467
Molecular FormulaC11H22F3N3
Molecular Weight253.31 g/mol
Exact Mass253.18
IUPAC Name(6,6,6-trifluoro-2-methyl-2-pyrrolidin-1-ylhexan-3-yl)hydrazine
SMILESCC(C)(C(CCC(F)(F)F)NN)N1CCCC1
InChIInChI=1S/C11H22F3N3/c1-10(2,17-7-3-4-8-17)9(16-15)5-6-11(12,13)14/h9,16H,3-8,15H2,1-2H3
InChIKeyPOUJOVDCQKXHMM-UHFFFAOYSA-N
XLogP2.04
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.31
LogP ≤ 52.04
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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Frequently Asked Questions

What is the IUPAC name of (6,6,6-trifluoro-2-methyl-2-pyrrolidin-1-ylhexan-3-yl)hydrazine?
The IUPAC name of (6,6,6-trifluoro-2-methyl-2-pyrrolidin-1-ylhexan-3-yl)hydrazine (CID 105239467) is (6,6,6-trifluoro-2-methyl-2-pyrrolidin-1-ylhexan-3-yl)hydrazine.
What is the SMILES notation for (6,6,6-trifluoro-2-methyl-2-pyrrolidin-1-ylhexan-3-yl)hydrazine?
The canonical SMILES for (6,6,6-trifluoro-2-methyl-2-pyrrolidin-1-ylhexan-3-yl)hydrazine is CC(C)(C(CCC(F)(F)F)NN)N1CCCC1.
What is the InChIKey of (6,6,6-trifluoro-2-methyl-2-pyrrolidin-1-ylhexan-3-yl)hydrazine?
The InChIKey is POUJOVDCQKXHMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22F3N3/c1-10(2,17-7-3-4-8-17)9(16-15)5-6-11(12,13)14/h9,16H,3-8,15H2,1-2H3.
What are the key properties of (6,6,6-trifluoro-2-methyl-2-pyrrolidin-1-ylhexan-3-yl)hydrazine?
(6,6,6-trifluoro-2-methyl-2-pyrrolidin-1-ylhexan-3-yl)hydrazine has a molecular weight of 253.31 g/mol, XLogP of 2.04, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6,6,6-trifluoro-2-methyl-2-pyrrolidin-1-ylhexan-3-yl)hydrazine is sourced from PubChem (CID 105239467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).