N-(6,6,6-trifluorohexan-2-yl)morpholin-4-amine

C10H19F3N2O — CID 116534976

IUPACN-(6,6,6-trifluorohexan-2-yl)morpholin-4-amine
SMILESCC(CCCC(F)(F)F)NN1CCOCC1
InChIInChI=1S/C10H19F3N2O/c1-9(3-2-4-10(11,12)13)14-15-5-7-16-8-6-15/h9,14H,2-8H2,1H3
InChIKeyBAHDPGSFQXHSDV-UHFFFAOYSA-N
MW240.27 g/mol
LogP1.94
Rot. Bonds5

About N-(6,6,6-trifluorohexan-2-yl)morpholin-4-amine

N-(6,6,6-trifluorohexan-2-yl)morpholin-4-amine (PubChem CID 116534976) has the molecular formula C10H19F3N2O and a molecular weight of 240.27 g/mol. Its IUPAC name is N-(6,6,6-trifluorohexan-2-yl)morpholin-4-amine.

Molecular Properties

Compound NameN-(6,6,6-trifluorohexan-2-yl)morpholin-4-amine
PubChem CID116534976
Molecular FormulaC10H19F3N2O
Molecular Weight240.27 g/mol
Exact Mass240.14
IUPAC NameN-(6,6,6-trifluorohexan-2-yl)morpholin-4-amine
SMILESCC(CCCC(F)(F)F)NN1CCOCC1
InChIInChI=1S/C10H19F3N2O/c1-9(3-2-4-10(11,12)13)14-15-5-7-16-8-6-15/h9,14H,2-8H2,1H3
InChIKeyBAHDPGSFQXHSDV-UHFFFAOYSA-N
XLogP1.94
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.27
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(6,6,6-trifluorohexan-2-yl)morpholin-4-amine?
The IUPAC name of N-(6,6,6-trifluorohexan-2-yl)morpholin-4-amine (CID 116534976) is N-(6,6,6-trifluorohexan-2-yl)morpholin-4-amine.
What is the SMILES notation for N-(6,6,6-trifluorohexan-2-yl)morpholin-4-amine?
The canonical SMILES for N-(6,6,6-trifluorohexan-2-yl)morpholin-4-amine is CC(CCCC(F)(F)F)NN1CCOCC1.
What is the InChIKey of N-(6,6,6-trifluorohexan-2-yl)morpholin-4-amine?
The InChIKey is BAHDPGSFQXHSDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19F3N2O/c1-9(3-2-4-10(11,12)13)14-15-5-7-16-8-6-15/h9,14H,2-8H2,1H3.
What are the key properties of N-(6,6,6-trifluorohexan-2-yl)morpholin-4-amine?
N-(6,6,6-trifluorohexan-2-yl)morpholin-4-amine has a molecular weight of 240.27 g/mol, XLogP of 1.94, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6,6,6-trifluorohexan-2-yl)morpholin-4-amine is sourced from PubChem (CID 116534976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).