4-chloro-N-methoxy-N-methyl-2-(trifluoromethyl)benzamide

C10H9ClF3NO2 — CID 162570663

IUPAC4-chloro-N-methoxy-N-methyl-2-(trifluoromethyl)benzamide
SMILESCON(C)C(=O)c1ccc(Cl)cc1C(F)(F)F
InChIInChI=1S/C10H9ClF3NO2/c1-15(17-2)9(16)7-4-3-6(11)5-8(7)10(12,13)14/h3-5H,1-2H3
InChIKeyRKBQPQWASHGOIT-UHFFFAOYSA-N
MW267.63 g/mol
LogP2.99
Rot. Bonds2

About 4-chloro-N-methoxy-N-methyl-2-(trifluoromethyl)benzamide

4-chloro-N-methoxy-N-methyl-2-(trifluoromethyl)benzamide (PubChem CID 162570663) has the molecular formula C10H9ClF3NO2 and a molecular weight of 267.63 g/mol. Its IUPAC name is 4-chloro-N-methoxy-N-methyl-2-(trifluoromethyl)benzamide.

Molecular Properties

Compound Name4-chloro-N-methoxy-N-methyl-2-(trifluoromethyl)benzamide
PubChem CID162570663
Molecular FormulaC10H9ClF3NO2
Molecular Weight267.63 g/mol
Exact Mass267.03
IUPAC Name4-chloro-N-methoxy-N-methyl-2-(trifluoromethyl)benzamide
SMILESCON(C)C(=O)c1ccc(Cl)cc1C(F)(F)F
InChIInChI=1S/C10H9ClF3NO2/c1-15(17-2)9(16)7-4-3-6(11)5-8(7)10(12,13)14/h3-5H,1-2H3
InChIKeyRKBQPQWASHGOIT-UHFFFAOYSA-N
XLogP2.99
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.63
LogP ≤ 52.99
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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Related Compounds

1-[4-chloro-2-(trifluoromethyl)phenyl]-2-methoxypropan-1-one
CID 134400354
4-chloro-2-(trifluoromethyl)benzamide;dihydrochloride
CID 22563807
6-[(6-chloro-3-pyridinyl)oxy]-N-methoxy-N-methyl-4-(trifluoromethyl)pyridine-3-carboxamide
CID 150863649
6-ethyl-N-methoxy-N-methyl-4-(trifluoromethyl)pyridine-3-carboxamide
CID 144787110
N-methoxy-N,3-dimethyl-4-(trifluoromethyl)benzamide
CID 86086315
magnesium;carbanide;6-(4-chlorophenoxy)-N-methoxy-N-methyl-2-(trifluoromethyl)pyridine-3-carboxamide;1-[6-(4-chlorophenoxy)-2-(trifluoromethyl)-3-pyridinyl]ethanone;bromide
CID 159888705
2-amino-4-fluoro-N-methoxy-N-methylbenzamide
CID 63110530
5-chloro-N-methoxy-N-methyl-2-(2-phenylethynyl)benzamide
CID 138974959
N-[4-chloro-2-(trifluoromethyl)phenyl]-2-methoxy-2-methylpropanamide
CID 103029050
[4-chloro-2-(trifluoromethyl)phenyl] acetate
CID 118592870
2-[N-acetyl-4-chloro-2-(trifluoromethyl)anilino]-N-(2-methoxyethyl)acetamide
CID 113179340
N-methoxy-N,3-dimethyl-4-(trifluoromethyl)benzamide;3-methyl-4-(trifluoromethyl)benzoic acid
CID 159162955

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-methoxy-N-methyl-2-(trifluoromethyl)benzamide?
The IUPAC name of 4-chloro-N-methoxy-N-methyl-2-(trifluoromethyl)benzamide (CID 162570663) is 4-chloro-N-methoxy-N-methyl-2-(trifluoromethyl)benzamide.
What is the SMILES notation for 4-chloro-N-methoxy-N-methyl-2-(trifluoromethyl)benzamide?
The canonical SMILES for 4-chloro-N-methoxy-N-methyl-2-(trifluoromethyl)benzamide is CON(C)C(=O)c1ccc(Cl)cc1C(F)(F)F.
What is the InChIKey of 4-chloro-N-methoxy-N-methyl-2-(trifluoromethyl)benzamide?
The InChIKey is RKBQPQWASHGOIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9ClF3NO2/c1-15(17-2)9(16)7-4-3-6(11)5-8(7)10(12,13)14/h3-5H,1-2H3.
What are the key properties of 4-chloro-N-methoxy-N-methyl-2-(trifluoromethyl)benzamide?
4-chloro-N-methoxy-N-methyl-2-(trifluoromethyl)benzamide has a molecular weight of 267.63 g/mol, XLogP of 2.99, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-methoxy-N-methyl-2-(trifluoromethyl)benzamide is sourced from PubChem (CID 162570663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).