(2R)-N,N,2-trimethyl-4-(2-phenylethyl)morpholine-2-carboxamide

C16H24N2O2 — CID 95839205

IUPAC(2R)-N,N,2-trimethyl-4-(2-phenylethyl)morpholine-2-carboxamide
SMILESCN(C)C(=O)[C@@]1(C)CN(CCc2ccccc2)CCO1
InChIInChI=1S/C16H24N2O2/c1-16(15(19)17(2)3)13-18(11-12-20-16)10-9-14-7-5-4-6-8-14/h4-8H,9-13H2,1-3H3/t16-/m1/s1
InChIKeyYWSWLULBZMRJND-MRXNPFEDSA-N
MW276.38 g/mol
LogP1.41
Rot. Bonds4

About (2R)-N,N,2-trimethyl-4-(2-phenylethyl)morpholine-2-carboxamide

(2R)-N,N,2-trimethyl-4-(2-phenylethyl)morpholine-2-carboxamide (PubChem CID 95839205) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is (2R)-N,N,2-trimethyl-4-(2-phenylethyl)morpholine-2-carboxamide.

Molecular Properties

Compound Name(2R)-N,N,2-trimethyl-4-(2-phenylethyl)morpholine-2-carboxamide
PubChem CID95839205
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC Name(2R)-N,N,2-trimethyl-4-(2-phenylethyl)morpholine-2-carboxamide
SMILESCN(C)C(=O)[C@@]1(C)CN(CCc2ccccc2)CCO1
InChIInChI=1S/C16H24N2O2/c1-16(15(19)17(2)3)13-18(11-12-20-16)10-9-14-7-5-4-6-8-14/h4-8H,9-13H2,1-3H3/t16-/m1/s1
InChIKeyYWSWLULBZMRJND-MRXNPFEDSA-N
XLogP1.41
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R)-N,N,2-trimethyl-4-(2-phenylethyl)morpholine-2-carboxamide?
The IUPAC name of (2R)-N,N,2-trimethyl-4-(2-phenylethyl)morpholine-2-carboxamide (CID 95839205) is (2R)-N,N,2-trimethyl-4-(2-phenylethyl)morpholine-2-carboxamide.
What is the SMILES notation for (2R)-N,N,2-trimethyl-4-(2-phenylethyl)morpholine-2-carboxamide?
The canonical SMILES for (2R)-N,N,2-trimethyl-4-(2-phenylethyl)morpholine-2-carboxamide is CN(C)C(=O)[C@@]1(C)CN(CCc2ccccc2)CCO1.
What is the InChIKey of (2R)-N,N,2-trimethyl-4-(2-phenylethyl)morpholine-2-carboxamide?
The InChIKey is YWSWLULBZMRJND-MRXNPFEDSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-16(15(19)17(2)3)13-18(11-12-20-16)10-9-14-7-5-4-6-8-14/h4-8H,9-13H2,1-3H3/t16-/m1/s1.
What are the key properties of (2R)-N,N,2-trimethyl-4-(2-phenylethyl)morpholine-2-carboxamide?
(2R)-N,N,2-trimethyl-4-(2-phenylethyl)morpholine-2-carboxamide has a molecular weight of 276.38 g/mol, XLogP of 1.41, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N,N,2-trimethyl-4-(2-phenylethyl)morpholine-2-carboxamide is sourced from PubChem (CID 95839205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).