N-cyclohexyl-4-methyl-N-(3,3,3-trifluoropropyl)morpholine-2-carboxamide

C15H25F3N2O2 — CID 71858932

IUPACN-cyclohexyl-4-methyl-N-(3,3,3-trifluoropropyl)morpholine-2-carboxamide
SMILESCN1CCOC(C(=O)N(CCC(F)(F)F)C2CCCCC2)C1
InChIInChI=1S/C15H25F3N2O2/c1-19-9-10-22-13(11-19)14(21)20(8-7-15(16,17)18)12-5-3-2-4-6-12/h12-13H,2-11H2,1H3
InChIKeyGIWCJMKFKXEBGT-UHFFFAOYSA-N
MW322.37 g/mol
LogP2.43
Rot. Bonds4

About N-cyclohexyl-4-methyl-N-(3,3,3-trifluoropropyl)morpholine-2-carboxamide

N-cyclohexyl-4-methyl-N-(3,3,3-trifluoropropyl)morpholine-2-carboxamide (PubChem CID 71858932) has the molecular formula C15H25F3N2O2 and a molecular weight of 322.37 g/mol. Its IUPAC name is N-cyclohexyl-4-methyl-N-(3,3,3-trifluoropropyl)morpholine-2-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-4-methyl-N-(3,3,3-trifluoropropyl)morpholine-2-carboxamide
PubChem CID71858932
Molecular FormulaC15H25F3N2O2
Molecular Weight322.37 g/mol
Exact Mass322.19
IUPAC NameN-cyclohexyl-4-methyl-N-(3,3,3-trifluoropropyl)morpholine-2-carboxamide
SMILESCN1CCOC(C(=O)N(CCC(F)(F)F)C2CCCCC2)C1
InChIInChI=1S/C15H25F3N2O2/c1-19-9-10-22-13(11-19)14(21)20(8-7-15(16,17)18)12-5-3-2-4-6-12/h12-13H,2-11H2,1H3
InChIKeyGIWCJMKFKXEBGT-UHFFFAOYSA-N
XLogP2.43
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.37
LogP ≤ 52.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-4-methyl-N-(3,3,3-trifluoropropyl)morpholine-2-carboxamide?
The IUPAC name of N-cyclohexyl-4-methyl-N-(3,3,3-trifluoropropyl)morpholine-2-carboxamide (CID 71858932) is N-cyclohexyl-4-methyl-N-(3,3,3-trifluoropropyl)morpholine-2-carboxamide.
What is the SMILES notation for N-cyclohexyl-4-methyl-N-(3,3,3-trifluoropropyl)morpholine-2-carboxamide?
The canonical SMILES for N-cyclohexyl-4-methyl-N-(3,3,3-trifluoropropyl)morpholine-2-carboxamide is CN1CCOC(C(=O)N(CCC(F)(F)F)C2CCCCC2)C1.
What is the InChIKey of N-cyclohexyl-4-methyl-N-(3,3,3-trifluoropropyl)morpholine-2-carboxamide?
The InChIKey is GIWCJMKFKXEBGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25F3N2O2/c1-19-9-10-22-13(11-19)14(21)20(8-7-15(16,17)18)12-5-3-2-4-6-12/h12-13H,2-11H2,1H3.
What are the key properties of N-cyclohexyl-4-methyl-N-(3,3,3-trifluoropropyl)morpholine-2-carboxamide?
N-cyclohexyl-4-methyl-N-(3,3,3-trifluoropropyl)morpholine-2-carboxamide has a molecular weight of 322.37 g/mol, XLogP of 2.43, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-4-methyl-N-(3,3,3-trifluoropropyl)morpholine-2-carboxamide is sourced from PubChem (CID 71858932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).