2-(2-hydroxyethylamino)-N-[4-(trifluoromethoxy)phenyl]acetamide

C11H13F3N2O3 — CID 71628791

IUPAC2-(2-hydroxyethylamino)-N-[4-(trifluoromethoxy)phenyl]acetamide
SMILESO=C(CNCCO)Nc1ccc(OC(F)(F)F)cc1
InChIInChI=1S/C11H13F3N2O3/c12-11(13,14)19-9-3-1-8(2-4-9)16-10(18)7-15-5-6-17/h1-4,15,17H,5-7H2,(H,16,18)
InChIKeyJXQYHZVJFFQVIQ-UHFFFAOYSA-N
MW278.23 g/mol
LogP1.11
Rot. Bonds6

About 2-(2-hydroxyethylamino)-N-[4-(trifluoromethoxy)phenyl]acetamide

2-(2-hydroxyethylamino)-N-[4-(trifluoromethoxy)phenyl]acetamide (PubChem CID 71628791) has the molecular formula C11H13F3N2O3 and a molecular weight of 278.23 g/mol. Its IUPAC name is 2-(2-hydroxyethylamino)-N-[4-(trifluoromethoxy)phenyl]acetamide.

Molecular Properties

Compound Name2-(2-hydroxyethylamino)-N-[4-(trifluoromethoxy)phenyl]acetamide
PubChem CID71628791
Molecular FormulaC11H13F3N2O3
Molecular Weight278.23 g/mol
Exact Mass278.09
IUPAC Name2-(2-hydroxyethylamino)-N-[4-(trifluoromethoxy)phenyl]acetamide
SMILESO=C(CNCCO)Nc1ccc(OC(F)(F)F)cc1
InChIInChI=1S/C11H13F3N2O3/c12-11(13,14)19-9-3-1-8(2-4-9)16-10(18)7-15-5-6-17/h1-4,15,17H,5-7H2,(H,16,18)
InChIKeyJXQYHZVJFFQVIQ-UHFFFAOYSA-N
XLogP1.11
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.23
LogP ≤ 51.11
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(cyclopropylmethylamino)-N-[4-(trifluoromethoxy)phenyl]acetamide
CID 60842957
3,3,3-trifluoro-N-[4-(trifluoromethoxy)phenyl]propanamide
CID 174736453
5-hydroxy-N-[4-(trifluoromethoxy)phenyl]pentanamide
CID 79198633
N-(4-acetamidophenyl)-2-(2-hydroxyethylamino)acetamide
CID 82358506
methyl 4-[[2-(2-hydroxyethylamino)acetyl]amino]benzoate
CID 82358503
N'-[4-(trifluoromethoxy)phenyl]propanediamide
CID 140529911
2-(oxolan-2-ylmethylamino)-N-[4-(trifluoromethoxy)phenyl]acetamide
CID 119672849
2-(2,3,4,5,6-pentafluorophenyl)-N-[4-(trifluoromethoxy)phenyl]acetamide
CID 5010640
4-bromo-N-[2-oxo-2-[4-(trifluoromethoxy)anilino]ethyl]benzamide
CID 35184223
N-[4-(trifluoromethoxy)phenyl]carbamoyl chloride
CID 22420988
[4-(trifluoromethoxy)phenyl]urea
CID 2779224
2-(4-chlorophenyl)-N-[4-(trifluoromethoxy)phenyl]acetamide
CID 2678277

Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxyethylamino)-N-[4-(trifluoromethoxy)phenyl]acetamide?
The IUPAC name of 2-(2-hydroxyethylamino)-N-[4-(trifluoromethoxy)phenyl]acetamide (CID 71628791) is 2-(2-hydroxyethylamino)-N-[4-(trifluoromethoxy)phenyl]acetamide.
What is the SMILES notation for 2-(2-hydroxyethylamino)-N-[4-(trifluoromethoxy)phenyl]acetamide?
The canonical SMILES for 2-(2-hydroxyethylamino)-N-[4-(trifluoromethoxy)phenyl]acetamide is O=C(CNCCO)Nc1ccc(OC(F)(F)F)cc1.
What is the InChIKey of 2-(2-hydroxyethylamino)-N-[4-(trifluoromethoxy)phenyl]acetamide?
The InChIKey is JXQYHZVJFFQVIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13F3N2O3/c12-11(13,14)19-9-3-1-8(2-4-9)16-10(18)7-15-5-6-17/h1-4,15,17H,5-7H2,(H,16,18).
What are the key properties of 2-(2-hydroxyethylamino)-N-[4-(trifluoromethoxy)phenyl]acetamide?
2-(2-hydroxyethylamino)-N-[4-(trifluoromethoxy)phenyl]acetamide has a molecular weight of 278.23 g/mol, XLogP of 1.11, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxyethylamino)-N-[4-(trifluoromethoxy)phenyl]acetamide is sourced from PubChem (CID 71628791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).