N,N-diethyl-1-(4,4,4-trifluoro-1-hydrazinylbutyl)cyclopentan-1-amine

C13H26F3N3 — CID 105242573

IUPACN,N-diethyl-1-(4,4,4-trifluoro-1-hydrazinylbutyl)cyclopentan-1-amine
SMILESCCN(CC)C1(C(CCC(F)(F)F)NN)CCCC1
InChIInChI=1S/C13H26F3N3/c1-3-19(4-2)12(8-5-6-9-12)11(18-17)7-10-13(14,15)16/h11,18H,3-10,17H2,1-2H3
InChIKeyOADSNZCXEKQWPG-UHFFFAOYSA-N
MW281.37 g/mol
LogP2.82
Rot. Bonds7

About N,N-diethyl-1-(4,4,4-trifluoro-1-hydrazinylbutyl)cyclopentan-1-amine

N,N-diethyl-1-(4,4,4-trifluoro-1-hydrazinylbutyl)cyclopentan-1-amine (PubChem CID 105242573) has the molecular formula C13H26F3N3 and a molecular weight of 281.37 g/mol. Its IUPAC name is N,N-diethyl-1-(4,4,4-trifluoro-1-hydrazinylbutyl)cyclopentan-1-amine.

Molecular Properties

Compound NameN,N-diethyl-1-(4,4,4-trifluoro-1-hydrazinylbutyl)cyclopentan-1-amine
PubChem CID105242573
Molecular FormulaC13H26F3N3
Molecular Weight281.37 g/mol
Exact Mass281.21
IUPAC NameN,N-diethyl-1-(4,4,4-trifluoro-1-hydrazinylbutyl)cyclopentan-1-amine
SMILESCCN(CC)C1(C(CCC(F)(F)F)NN)CCCC1
InChIInChI=1S/C13H26F3N3/c1-3-19(4-2)12(8-5-6-9-12)11(18-17)7-10-13(14,15)16/h11,18H,3-10,17H2,1-2H3
InChIKeyOADSNZCXEKQWPG-UHFFFAOYSA-N
XLogP2.82
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.37
LogP ≤ 52.82
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 N,N-diethyl-1-(4,4,4-trifluoro-1-hydrazinylbutyl)cyclopentan-1-amine?
The IUPAC name of N,N-diethyl-1-(4,4,4-trifluoro-1-hydrazinylbutyl)cyclopentan-1-amine (CID 105242573) is N,N-diethyl-1-(4,4,4-trifluoro-1-hydrazinylbutyl)cyclopentan-1-amine.
What is the SMILES notation for N,N-diethyl-1-(4,4,4-trifluoro-1-hydrazinylbutyl)cyclopentan-1-amine?
The canonical SMILES for N,N-diethyl-1-(4,4,4-trifluoro-1-hydrazinylbutyl)cyclopentan-1-amine is CCN(CC)C1(C(CCC(F)(F)F)NN)CCCC1.
What is the InChIKey of N,N-diethyl-1-(4,4,4-trifluoro-1-hydrazinylbutyl)cyclopentan-1-amine?
The InChIKey is OADSNZCXEKQWPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26F3N3/c1-3-19(4-2)12(8-5-6-9-12)11(18-17)7-10-13(14,15)16/h11,18H,3-10,17H2,1-2H3.
What are the key properties of N,N-diethyl-1-(4,4,4-trifluoro-1-hydrazinylbutyl)cyclopentan-1-amine?
N,N-diethyl-1-(4,4,4-trifluoro-1-hydrazinylbutyl)cyclopentan-1-amine has a molecular weight of 281.37 g/mol, XLogP of 2.82, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-1-(4,4,4-trifluoro-1-hydrazinylbutyl)cyclopentan-1-amine is sourced from PubChem (CID 105242573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).