[1-(2,6-dimethylmorpholin-4-yl)-3-(trifluoromethyl)cyclohexyl]methanamine

C14H25F3N2O — CID 64759439

IUPAC[1-(2,6-dimethylmorpholin-4-yl)-3-(trifluoromethyl)cyclohexyl]methanamine
SMILESCC1CN(C2(CN)CCCC(C(F)(F)F)C2)CC(C)O1
InChIInChI=1S/C14H25F3N2O/c1-10-7-19(8-11(2)20-10)13(9-18)5-3-4-12(6-13)14(15,16)17/h10-12H,3-9,18H2,1-2H3
InChIKeyUDQJDCIPNZNVHH-UHFFFAOYSA-N
MW294.36 g/mol
LogP2.55
Rot. Bonds2

About [1-(2,6-dimethylmorpholin-4-yl)-3-(trifluoromethyl)cyclohexyl]methanamine

[1-(2,6-dimethylmorpholin-4-yl)-3-(trifluoromethyl)cyclohexyl]methanamine (PubChem CID 64759439) has the molecular formula C14H25F3N2O and a molecular weight of 294.36 g/mol. Its IUPAC name is [1-(2,6-dimethylmorpholin-4-yl)-3-(trifluoromethyl)cyclohexyl]methanamine.

Molecular Properties

Compound Name[1-(2,6-dimethylmorpholin-4-yl)-3-(trifluoromethyl)cyclohexyl]methanamine
PubChem CID64759439
Molecular FormulaC14H25F3N2O
Molecular Weight294.36 g/mol
Exact Mass294.19
IUPAC Name[1-(2,6-dimethylmorpholin-4-yl)-3-(trifluoromethyl)cyclohexyl]methanamine
SMILESCC1CN(C2(CN)CCCC(C(F)(F)F)C2)CC(C)O1
InChIInChI=1S/C14H25F3N2O/c1-10-7-19(8-11(2)20-10)13(9-18)5-3-4-12(6-13)14(15,16)17/h10-12H,3-9,18H2,1-2H3
InChIKeyUDQJDCIPNZNVHH-UHFFFAOYSA-N
XLogP2.55
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.36
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [1-(2,6-dimethylmorpholin-4-yl)-3-(trifluoromethyl)cyclohexyl]methanamine?
The IUPAC name of [1-(2,6-dimethylmorpholin-4-yl)-3-(trifluoromethyl)cyclohexyl]methanamine (CID 64759439) is [1-(2,6-dimethylmorpholin-4-yl)-3-(trifluoromethyl)cyclohexyl]methanamine.
What is the SMILES notation for [1-(2,6-dimethylmorpholin-4-yl)-3-(trifluoromethyl)cyclohexyl]methanamine?
The canonical SMILES for [1-(2,6-dimethylmorpholin-4-yl)-3-(trifluoromethyl)cyclohexyl]methanamine is CC1CN(C2(CN)CCCC(C(F)(F)F)C2)CC(C)O1.
What is the InChIKey of [1-(2,6-dimethylmorpholin-4-yl)-3-(trifluoromethyl)cyclohexyl]methanamine?
The InChIKey is UDQJDCIPNZNVHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25F3N2O/c1-10-7-19(8-11(2)20-10)13(9-18)5-3-4-12(6-13)14(15,16)17/h10-12H,3-9,18H2,1-2H3.
What are the key properties of [1-(2,6-dimethylmorpholin-4-yl)-3-(trifluoromethyl)cyclohexyl]methanamine?
[1-(2,6-dimethylmorpholin-4-yl)-3-(trifluoromethyl)cyclohexyl]methanamine has a molecular weight of 294.36 g/mol, XLogP of 2.55, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,6-dimethylmorpholin-4-yl)-3-(trifluoromethyl)cyclohexyl]methanamine is sourced from PubChem (CID 64759439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).