(2R)-2-[[(2S)-4-methylmorpholin-2-yl]methylamino]-N-(2,2,2-trifluoroethyl)propanamide

C11H20F3N3O2 — CID 95293289

IUPAC(2R)-2-[[(2S)-4-methylmorpholin-2-yl]methylamino]-N-(2,2,2-trifluoroethyl)propanamide
SMILESC[C@@H](NC[C@H]1CN(C)CCO1)C(=O)NCC(F)(F)F
InChIInChI=1S/C11H20F3N3O2/c1-8(10(18)16-7-11(12,13)14)15-5-9-6-17(2)3-4-19-9/h8-9,15H,3-7H2,1-2H3,(H,16,18)/t8-,9+/m1/s1
InChIKeyLQTKATFPCLSJQL-BDAKNGLRSA-N
MW283.29 g/mol
LogP-0.03
Rot. Bonds5

About (2R)-2-[[(2S)-4-methylmorpholin-2-yl]methylamino]-N-(2,2,2-trifluoroethyl)propanamide

(2R)-2-[[(2S)-4-methylmorpholin-2-yl]methylamino]-N-(2,2,2-trifluoroethyl)propanamide (PubChem CID 95293289) has the molecular formula C11H20F3N3O2 and a molecular weight of 283.29 g/mol. Its IUPAC name is (2R)-2-[[(2S)-4-methylmorpholin-2-yl]methylamino]-N-(2,2,2-trifluoroethyl)propanamide.

Molecular Properties

Compound Name(2R)-2-[[(2S)-4-methylmorpholin-2-yl]methylamino]-N-(2,2,2-trifluoroethyl)propanamide
PubChem CID95293289
Molecular FormulaC11H20F3N3O2
Molecular Weight283.29 g/mol
Exact Mass283.15
IUPAC Name(2R)-2-[[(2S)-4-methylmorpholin-2-yl]methylamino]-N-(2,2,2-trifluoroethyl)propanamide
SMILESC[C@@H](NC[C@H]1CN(C)CCO1)C(=O)NCC(F)(F)F
InChIInChI=1S/C11H20F3N3O2/c1-8(10(18)16-7-11(12,13)14)15-5-9-6-17(2)3-4-19-9/h8-9,15H,3-7H2,1-2H3,(H,16,18)/t8-,9+/m1/s1
InChIKeyLQTKATFPCLSJQL-BDAKNGLRSA-N
XLogP-0.03
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.29
LogP ≤ 5-0.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-2-[(4-methylmorpholin-2-yl)methylamino]propanamide
CID 78945377
2-[(4-methylmorpholin-2-yl)methylamino]propanoic acid
CID 78967405
2-[(4-methylmorpholin-2-yl)methylamino]propanamide
CID 78945177
2-methyl-N-[[(2S)-4-methylmorpholin-2-yl]methyl]propanamide
CID 153398973
(2R)-1-(azepan-1-yl)-2-[[(2S)-4-methylmorpholin-2-yl]methylamino]propan-1-one
CID 95302737
N-[[(2S)-4-methylmorpholin-2-yl]methyl]propan-2-amine
CID 96645037
N-methyl-3-[(4-methylmorpholin-2-yl)methylamino]butanamide
CID 115889192
2-(oxolan-3-ylmethylamino)-N-(2,2,2-trifluoroethyl)propanamide
CID 115581038
2,3-dimethyl-4-[(4-methylmorpholin-2-yl)methylamino]-4-oxobutanoic acid
CID 103498729
N-ethyl-2-[(4-ethylmorpholin-2-yl)methylamino]propanamide
CID 78960400
(2S)-N-[(1S)-1-(4-chlorophenyl)ethyl]-2-[[(2R)-4-methylmorpholin-2-yl]methylamino]propanamide
CID 95327938
(1S)-1-cyclopropyl-N-[[(2S)-4-methylmorpholin-2-yl]methyl]ethanamine
CID 97045036

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[[(2S)-4-methylmorpholin-2-yl]methylamino]-N-(2,2,2-trifluoroethyl)propanamide?
The IUPAC name of (2R)-2-[[(2S)-4-methylmorpholin-2-yl]methylamino]-N-(2,2,2-trifluoroethyl)propanamide (CID 95293289) is (2R)-2-[[(2S)-4-methylmorpholin-2-yl]methylamino]-N-(2,2,2-trifluoroethyl)propanamide.
What is the SMILES notation for (2R)-2-[[(2S)-4-methylmorpholin-2-yl]methylamino]-N-(2,2,2-trifluoroethyl)propanamide?
The canonical SMILES for (2R)-2-[[(2S)-4-methylmorpholin-2-yl]methylamino]-N-(2,2,2-trifluoroethyl)propanamide is C[C@@H](NC[C@H]1CN(C)CCO1)C(=O)NCC(F)(F)F.
What is the InChIKey of (2R)-2-[[(2S)-4-methylmorpholin-2-yl]methylamino]-N-(2,2,2-trifluoroethyl)propanamide?
The InChIKey is LQTKATFPCLSJQL-BDAKNGLRSA-N. The full InChI is InChI=1S/C11H20F3N3O2/c1-8(10(18)16-7-11(12,13)14)15-5-9-6-17(2)3-4-19-9/h8-9,15H,3-7H2,1-2H3,(H,16,18)/t8-,9+/m1/s1.
What are the key properties of (2R)-2-[[(2S)-4-methylmorpholin-2-yl]methylamino]-N-(2,2,2-trifluoroethyl)propanamide?
(2R)-2-[[(2S)-4-methylmorpholin-2-yl]methylamino]-N-(2,2,2-trifluoroethyl)propanamide has a molecular weight of 283.29 g/mol, XLogP of -0.03, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[[(2S)-4-methylmorpholin-2-yl]methylamino]-N-(2,2,2-trifluoroethyl)propanamide is sourced from PubChem (CID 95293289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).