2-morpholin-2-yl-N-[1-[3-(trifluoromethyl)phenyl]ethyl]acetamide;hydrochloride

C15H20ClF3N2O2 — CID 119686331

IUPAC2-morpholin-2-yl-N-[1-[3-(trifluoromethyl)phenyl]ethyl]acetamide;hydrochloride
SMILESCC(NC(=O)CC1CNCCO1)c1cccc(C(F)(F)F)c1.Cl
InChIInChI=1S/C15H19F3N2O2.ClH/c1-10(11-3-2-4-12(7-11)15(16,17)18)20-14(21)8-13-9-19-5-6-22-13;/h2-4,7,10,13,19H,5-6,8-9H2,1H3,(H,20,21);1H
InChIKeyWDULEADEKNWOAB-UHFFFAOYSA-N
MW352.78 g/mol
LogP2.68
Rot. Bonds4

About 2-morpholin-2-yl-N-[1-[3-(trifluoromethyl)phenyl]ethyl]acetamide;hydrochloride

2-morpholin-2-yl-N-[1-[3-(trifluoromethyl)phenyl]ethyl]acetamide;hydrochloride (PubChem CID 119686331) has the molecular formula C15H20ClF3N2O2 and a molecular weight of 352.78 g/mol. Its IUPAC name is 2-morpholin-2-yl-N-[1-[3-(trifluoromethyl)phenyl]ethyl]acetamide;hydrochloride.

Molecular Properties

Compound Name2-morpholin-2-yl-N-[1-[3-(trifluoromethyl)phenyl]ethyl]acetamide;hydrochloride
PubChem CID119686331
Molecular FormulaC15H20ClF3N2O2
Molecular Weight352.78 g/mol
Exact Mass352.12
IUPAC Name2-morpholin-2-yl-N-[1-[3-(trifluoromethyl)phenyl]ethyl]acetamide;hydrochloride
SMILESCC(NC(=O)CC1CNCCO1)c1cccc(C(F)(F)F)c1.Cl
InChIInChI=1S/C15H19F3N2O2.ClH/c1-10(11-3-2-4-12(7-11)15(16,17)18)20-14(21)8-13-9-19-5-6-22-13;/h2-4,7,10,13,19H,5-6,8-9H2,1H3,(H,20,21);1H
InChIKeyWDULEADEKNWOAB-UHFFFAOYSA-N
XLogP2.68
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.78
LogP ≤ 52.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1S)-1-(3-bromophenyl)ethyl]-2-morpholin-2-ylacetamide
CID 81376334
N-[1-(3-acetamidophenyl)ethyl]-2-morpholin-2-ylacetamide;hydrochloride
CID 119710822
N-[1-[3-(trifluoromethyl)phenyl]ethyl]morpholine-2-carboxamide;hydrochloride
CID 119686341
N-[1-[3-(difluoromethoxy)phenyl]ethyl]-2-morpholin-2-ylacetamide
CID 119720082
2-morpholin-2-yl-N-[1-(4-propan-2-ylphenyl)ethyl]acetamide;hydrochloride
CID 119686106
2-(oxolan-2-ylmethylamino)-N-[1-[3-(trifluoromethyl)phenyl]ethyl]acetamide;hydrochloride
CID 119686315
N-benzhydryl-2-morpholin-2-ylacetamide;hydrochloride
CID 119675556
N-[(1S)-1-(furan-2-yl)ethyl]-2-morpholin-2-ylacetamide
CID 81400402
3-piperidin-3-yl-N-[1-[3-(trifluoromethyl)phenyl]ethyl]butanamide
CID 119686323
2-morpholin-2-yl-N-(1-phenylpropyl)acetamide
CID 66427474
N-[3-[3-(trifluoromethyl)phenyl]butyl]morpholine-2-carboxamide
CID 119814995
2-(propan-2-ylamino)-N-[1-[3-(trifluoromethyl)phenyl]ethyl]acetamide
CID 60683177

Frequently Asked Questions

What is the IUPAC name of 2-morpholin-2-yl-N-[1-[3-(trifluoromethyl)phenyl]ethyl]acetamide;hydrochloride?
The IUPAC name of 2-morpholin-2-yl-N-[1-[3-(trifluoromethyl)phenyl]ethyl]acetamide;hydrochloride (CID 119686331) is 2-morpholin-2-yl-N-[1-[3-(trifluoromethyl)phenyl]ethyl]acetamide;hydrochloride.
What is the SMILES notation for 2-morpholin-2-yl-N-[1-[3-(trifluoromethyl)phenyl]ethyl]acetamide;hydrochloride?
The canonical SMILES for 2-morpholin-2-yl-N-[1-[3-(trifluoromethyl)phenyl]ethyl]acetamide;hydrochloride is CC(NC(=O)CC1CNCCO1)c1cccc(C(F)(F)F)c1.Cl.
What is the InChIKey of 2-morpholin-2-yl-N-[1-[3-(trifluoromethyl)phenyl]ethyl]acetamide;hydrochloride?
The InChIKey is WDULEADEKNWOAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19F3N2O2.ClH/c1-10(11-3-2-4-12(7-11)15(16,17)18)20-14(21)8-13-9-19-5-6-22-13;/h2-4,7,10,13,19H,5-6,8-9H2,1H3,(H,20,21);1H.
What are the key properties of 2-morpholin-2-yl-N-[1-[3-(trifluoromethyl)phenyl]ethyl]acetamide;hydrochloride?
2-morpholin-2-yl-N-[1-[3-(trifluoromethyl)phenyl]ethyl]acetamide;hydrochloride has a molecular weight of 352.78 g/mol, XLogP of 2.68, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-2-yl-N-[1-[3-(trifluoromethyl)phenyl]ethyl]acetamide;hydrochloride is sourced from PubChem (CID 119686331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).