2-methyl-N-[[4-(trifluoromethyl)morpholin-2-yl]methyl]propan-2-amine

C10H19F3N2O — CID 162424213

IUPAC2-methyl-N-[[4-(trifluoromethyl)morpholin-2-yl]methyl]propan-2-amine
SMILESCC(C)(C)NCC1CN(C(F)(F)F)CCO1
InChIInChI=1S/C10H19F3N2O/c1-9(2,3)14-6-8-7-15(4-5-16-8)10(11,12)13/h8,14H,4-7H2,1-3H3
InChIKeyCYUZZGMCKPGVIG-UHFFFAOYSA-N
MW240.27 g/mol
LogP1.60
Rot. Bonds2

About 2-methyl-N-[[4-(trifluoromethyl)morpholin-2-yl]methyl]propan-2-amine

2-methyl-N-[[4-(trifluoromethyl)morpholin-2-yl]methyl]propan-2-amine (PubChem CID 162424213) has the molecular formula C10H19F3N2O and a molecular weight of 240.27 g/mol. Its IUPAC name is 2-methyl-N-[[4-(trifluoromethyl)morpholin-2-yl]methyl]propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-[[4-(trifluoromethyl)morpholin-2-yl]methyl]propan-2-amine
PubChem CID162424213
Molecular FormulaC10H19F3N2O
Molecular Weight240.27 g/mol
Exact Mass240.14
IUPAC Name2-methyl-N-[[4-(trifluoromethyl)morpholin-2-yl]methyl]propan-2-amine
SMILESCC(C)(C)NCC1CN(C(F)(F)F)CCO1
InChIInChI=1S/C10H19F3N2O/c1-9(2,3)14-6-8-7-15(4-5-16-8)10(11,12)13/h8,14H,4-7H2,1-3H3
InChIKeyCYUZZGMCKPGVIG-UHFFFAOYSA-N
XLogP1.60
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.27
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-C-halo', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[[4-(trifluoromethyl)morpholin-2-yl]methyl]propan-2-amine?
The IUPAC name of 2-methyl-N-[[4-(trifluoromethyl)morpholin-2-yl]methyl]propan-2-amine (CID 162424213) is 2-methyl-N-[[4-(trifluoromethyl)morpholin-2-yl]methyl]propan-2-amine.
What is the SMILES notation for 2-methyl-N-[[4-(trifluoromethyl)morpholin-2-yl]methyl]propan-2-amine?
The canonical SMILES for 2-methyl-N-[[4-(trifluoromethyl)morpholin-2-yl]methyl]propan-2-amine is CC(C)(C)NCC1CN(C(F)(F)F)CCO1.
What is the InChIKey of 2-methyl-N-[[4-(trifluoromethyl)morpholin-2-yl]methyl]propan-2-amine?
The InChIKey is CYUZZGMCKPGVIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19F3N2O/c1-9(2,3)14-6-8-7-15(4-5-16-8)10(11,12)13/h8,14H,4-7H2,1-3H3.
What are the key properties of 2-methyl-N-[[4-(trifluoromethyl)morpholin-2-yl]methyl]propan-2-amine?
2-methyl-N-[[4-(trifluoromethyl)morpholin-2-yl]methyl]propan-2-amine has a molecular weight of 240.27 g/mol, XLogP of 1.60, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[[4-(trifluoromethyl)morpholin-2-yl]methyl]propan-2-amine is sourced from PubChem (CID 162424213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).