N-methoxy-2-[4-(trifluoromethyl)phenyl]acetamide

C10H10F3NO2 — CID 14273310

IUPACN-methoxy-2-[4-(trifluoromethyl)phenyl]acetamide
SMILESCONC(=O)Cc1ccc(C(F)(F)F)cc1
InChIInChI=1S/C10H10F3NO2/c1-16-14-9(15)6-7-2-4-8(5-3-7)10(11,12)13/h2-5H,6H2,1H3,(H,14,15)
InChIKeyBBHBCVZHWNCVHS-UHFFFAOYSA-N
MW233.19 g/mol
LogP1.93
Rot. Bonds3

About N-methoxy-2-[4-(trifluoromethyl)phenyl]acetamide

N-methoxy-2-[4-(trifluoromethyl)phenyl]acetamide (PubChem CID 14273310) has the molecular formula C10H10F3NO2 and a molecular weight of 233.19 g/mol. Its IUPAC name is N-methoxy-2-[4-(trifluoromethyl)phenyl]acetamide.

Molecular Properties

Compound NameN-methoxy-2-[4-(trifluoromethyl)phenyl]acetamide
PubChem CID14273310
Molecular FormulaC10H10F3NO2
Molecular Weight233.19 g/mol
Exact Mass233.07
IUPAC NameN-methoxy-2-[4-(trifluoromethyl)phenyl]acetamide
SMILESCONC(=O)Cc1ccc(C(F)(F)F)cc1
InChIInChI=1S/C10H10F3NO2/c1-16-14-9(15)6-7-2-4-8(5-3-7)10(11,12)13/h2-5H,6H2,1H3,(H,14,15)
InChIKeyBBHBCVZHWNCVHS-UHFFFAOYSA-N
XLogP1.93
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.19
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-methoxy-2-[4-(trifluoromethyl)phenyl]acetamide?
The IUPAC name of N-methoxy-2-[4-(trifluoromethyl)phenyl]acetamide (CID 14273310) is N-methoxy-2-[4-(trifluoromethyl)phenyl]acetamide.
What is the SMILES notation for N-methoxy-2-[4-(trifluoromethyl)phenyl]acetamide?
The canonical SMILES for N-methoxy-2-[4-(trifluoromethyl)phenyl]acetamide is CONC(=O)Cc1ccc(C(F)(F)F)cc1.
What is the InChIKey of N-methoxy-2-[4-(trifluoromethyl)phenyl]acetamide?
The InChIKey is BBHBCVZHWNCVHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F3NO2/c1-16-14-9(15)6-7-2-4-8(5-3-7)10(11,12)13/h2-5H,6H2,1H3,(H,14,15).
What are the key properties of N-methoxy-2-[4-(trifluoromethyl)phenyl]acetamide?
N-methoxy-2-[4-(trifluoromethyl)phenyl]acetamide has a molecular weight of 233.19 g/mol, XLogP of 1.93, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-2-[4-(trifluoromethyl)phenyl]acetamide is sourced from PubChem (CID 14273310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).