N-methoxy-N-methyl-3-(trifluoromethyl)benzamide

C10H10F3NO2 — CID 14069349

IUPACN-methoxy-N-methyl-3-(trifluoromethyl)benzamide
SMILESCON(C)C(=O)c1cccc(C(F)(F)F)c1
InChIInChI=1S/C10H10F3NO2/c1-14(16-2)9(15)7-4-3-5-8(6-7)10(11,12)13/h3-6H,1-2H3
InChIKeyPAXXRRIUUCZPEU-UHFFFAOYSA-N
MW233.19 g/mol
LogP2.34
Rot. Bonds2

About N-methoxy-N-methyl-3-(trifluoromethyl)benzamide

N-methoxy-N-methyl-3-(trifluoromethyl)benzamide (PubChem CID 14069349) has the molecular formula C10H10F3NO2 and a molecular weight of 233.19 g/mol. Its IUPAC name is N-methoxy-N-methyl-3-(trifluoromethyl)benzamide.

Molecular Properties

Compound NameN-methoxy-N-methyl-3-(trifluoromethyl)benzamide
PubChem CID14069349
Molecular FormulaC10H10F3NO2
Molecular Weight233.19 g/mol
Exact Mass233.07
IUPAC NameN-methoxy-N-methyl-3-(trifluoromethyl)benzamide
SMILESCON(C)C(=O)c1cccc(C(F)(F)F)c1
InChIInChI=1S/C10H10F3NO2/c1-14(16-2)9(15)7-4-3-5-8(6-7)10(11,12)13/h3-6H,1-2H3
InChIKeyPAXXRRIUUCZPEU-UHFFFAOYSA-N
XLogP2.34
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.19
LogP ≤ 52.34
H-Bond Donors ≤ 50
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-N-methyl-3-(trifluoromethyl)benzamide?
The IUPAC name of N-methoxy-N-methyl-3-(trifluoromethyl)benzamide (CID 14069349) is N-methoxy-N-methyl-3-(trifluoromethyl)benzamide.
What is the SMILES notation for N-methoxy-N-methyl-3-(trifluoromethyl)benzamide?
The canonical SMILES for N-methoxy-N-methyl-3-(trifluoromethyl)benzamide is CON(C)C(=O)c1cccc(C(F)(F)F)c1.
What is the InChIKey of N-methoxy-N-methyl-3-(trifluoromethyl)benzamide?
The InChIKey is PAXXRRIUUCZPEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F3NO2/c1-14(16-2)9(15)7-4-3-5-8(6-7)10(11,12)13/h3-6H,1-2H3.
What are the key properties of N-methoxy-N-methyl-3-(trifluoromethyl)benzamide?
N-methoxy-N-methyl-3-(trifluoromethyl)benzamide has a molecular weight of 233.19 g/mol, XLogP of 2.34, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-N-methyl-3-(trifluoromethyl)benzamide is sourced from PubChem (CID 14069349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).