2,2,2-trifluoro-N-(4-methyl-2-morpholin-4-ylpentyl)acetamide

C12H21F3N2O2 — CID 62491437

IUPAC2,2,2-trifluoro-N-(4-methyl-2-morpholin-4-ylpentyl)acetamide
SMILESCC(C)CC(CNC(=O)C(F)(F)F)N1CCOCC1
InChIInChI=1S/C12H21F3N2O2/c1-9(2)7-10(17-3-5-19-6-4-17)8-16-11(18)12(13,14)15/h9-10H,3-8H2,1-2H3,(H,16,18)
InChIKeySCJJFMPCDJMOPQ-UHFFFAOYSA-N
MW282.31 g/mol
LogP1.41
Rot. Bonds5

About 2,2,2-trifluoro-N-(4-methyl-2-morpholin-4-ylpentyl)acetamide

2,2,2-trifluoro-N-(4-methyl-2-morpholin-4-ylpentyl)acetamide (PubChem CID 62491437) has the molecular formula C12H21F3N2O2 and a molecular weight of 282.31 g/mol. Its IUPAC name is 2,2,2-trifluoro-N-(4-methyl-2-morpholin-4-ylpentyl)acetamide.

Molecular Properties

Compound Name2,2,2-trifluoro-N-(4-methyl-2-morpholin-4-ylpentyl)acetamide
PubChem CID62491437
Molecular FormulaC12H21F3N2O2
Molecular Weight282.31 g/mol
Exact Mass282.16
IUPAC Name2,2,2-trifluoro-N-(4-methyl-2-morpholin-4-ylpentyl)acetamide
SMILESCC(C)CC(CNC(=O)C(F)(F)F)N1CCOCC1
InChIInChI=1S/C12H21F3N2O2/c1-9(2)7-10(17-3-5-19-6-4-17)8-16-11(18)12(13,14)15/h9-10H,3-8H2,1-2H3,(H,16,18)
InChIKeySCJJFMPCDJMOPQ-UHFFFAOYSA-N
XLogP1.41
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.31
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-methyl-2-morpholin-4-ylpentyl)morpholine-4-carboxamide
CID 110403300
(2S)-2-amino-N-(4-methyl-2-morpholin-4-ylpentyl)propanamide
CID 78968953
tert-butyl N-(4-methyl-2-morpholin-4-ylpentyl)carbamate
CID 63787814
2-(4-chlorophenyl)-2-methyl-N-(4-methyl-2-morpholin-4-ylpentyl)propanamide
CID 55871235
2-(cyclopropylamino)-N-(4-methyl-2-morpholin-4-ylpentyl)acetamide
CID 61249539
1-(aminomethyl)-N-(4-methyl-2-morpholin-4-ylpentyl)cyclopropane-1-carboxamide
CID 115453115
(2E,4E)-N-(4-methyl-2-morpholin-4-ylpentyl)hexa-2,4-dienamide
CID 134053198
(2R)-2-amino-N-(4-methyl-2-morpholin-4-ylpentyl)pentanamide
CID 103813493
2-(aminomethyl)-N-(4-methyl-2-morpholin-4-ylpentyl)butanamide
CID 65229319
2-[(4-methyl-2-morpholin-4-ylpentyl)carbamoyl]cyclopropane-1-carboxylic acid
CID 60940730
2,2-dimethyl-N-[2-[[N'-methyl-N-(4-methyl-2-morpholin-4-ylpentyl)carbamimidoyl]amino]ethyl]propanamide;hydroiodide
CID 111936040
5-amino-N-(4-methyl-2-morpholin-4-ylpentyl)hexanamide
CID 82849469

Frequently Asked Questions

What is the IUPAC name of 2,2,2-trifluoro-N-(4-methyl-2-morpholin-4-ylpentyl)acetamide?
The IUPAC name of 2,2,2-trifluoro-N-(4-methyl-2-morpholin-4-ylpentyl)acetamide (CID 62491437) is 2,2,2-trifluoro-N-(4-methyl-2-morpholin-4-ylpentyl)acetamide.
What is the SMILES notation for 2,2,2-trifluoro-N-(4-methyl-2-morpholin-4-ylpentyl)acetamide?
The canonical SMILES for 2,2,2-trifluoro-N-(4-methyl-2-morpholin-4-ylpentyl)acetamide is CC(C)CC(CNC(=O)C(F)(F)F)N1CCOCC1.
What is the InChIKey of 2,2,2-trifluoro-N-(4-methyl-2-morpholin-4-ylpentyl)acetamide?
The InChIKey is SCJJFMPCDJMOPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21F3N2O2/c1-9(2)7-10(17-3-5-19-6-4-17)8-16-11(18)12(13,14)15/h9-10H,3-8H2,1-2H3,(H,16,18).
What are the key properties of 2,2,2-trifluoro-N-(4-methyl-2-morpholin-4-ylpentyl)acetamide?
2,2,2-trifluoro-N-(4-methyl-2-morpholin-4-ylpentyl)acetamide has a molecular weight of 282.31 g/mol, XLogP of 1.41, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,2-trifluoro-N-(4-methyl-2-morpholin-4-ylpentyl)acetamide is sourced from PubChem (CID 62491437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).