5-chloro-2-methoxy-N-[2-[4-(trifluoromethyl)phenoxy]ethyl]benzamide

C17H15ClF3NO3 — CID 55803100

IUPAC5-chloro-2-methoxy-N-[2-[4-(trifluoromethyl)phenoxy]ethyl]benzamide
SMILESCOc1ccc(Cl)cc1C(=O)NCCOc1ccc(C(F)(F)F)cc1
InChIInChI=1S/C17H15ClF3NO3/c1-24-15-7-4-12(18)10-14(15)16(23)22-8-9-25-13-5-2-11(3-6-13)17(19,20)21/h2-7,10H,8-9H2,1H3,(H,22,23)
InChIKeyVXVOIORNJBNVEC-UHFFFAOYSA-N
MW373.76 g/mol
LogP4.18
Rot. Bonds6

About 5-chloro-2-methoxy-N-[2-[4-(trifluoromethyl)phenoxy]ethyl]benzamide

5-chloro-2-methoxy-N-[2-[4-(trifluoromethyl)phenoxy]ethyl]benzamide (PubChem CID 55803100) has the molecular formula C17H15ClF3NO3 and a molecular weight of 373.76 g/mol. Its IUPAC name is 5-chloro-2-methoxy-N-[2-[4-(trifluoromethyl)phenoxy]ethyl]benzamide.

Molecular Properties

Compound Name5-chloro-2-methoxy-N-[2-[4-(trifluoromethyl)phenoxy]ethyl]benzamide
PubChem CID55803100
Molecular FormulaC17H15ClF3NO3
Molecular Weight373.76 g/mol
Exact Mass373.07
IUPAC Name5-chloro-2-methoxy-N-[2-[4-(trifluoromethyl)phenoxy]ethyl]benzamide
SMILESCOc1ccc(Cl)cc1C(=O)NCCOc1ccc(C(F)(F)F)cc1
InChIInChI=1S/C17H15ClF3NO3/c1-24-15-7-4-12(18)10-14(15)16(23)22-8-9-25-13-5-2-11(3-6-13)17(19,20)21/h2-7,10H,8-9H2,1H3,(H,22,23)
InChIKeyVXVOIORNJBNVEC-UHFFFAOYSA-N
XLogP4.18
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.76
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(4-chlorophenoxy)ethyl]-2-methoxy-5-methylbenzamide
CID 31336337
5-chloro-2-methoxy-N-[2-(2-methoxyphenoxy)ethyl]benzamide
CID 43009457
2-(2,5-dimethoxyphenyl)-N-[2-[4-(trifluoromethyl)phenoxy]ethyl]acetamide
CID 78892262
2-(4-chlorophenyl)-N-[2-[4-(trifluoromethyl)phenoxy]ethyl]acetamide
CID 55803102
5-chloro-N-[2-(2-chloroethoxy)ethyl]-2-methoxybenzamide
CID 114297830
N-[2-(4-methylphenoxy)ethyl]-4-(trifluoromethyl)benzamide
CID 8960957
5-chloro-2-methoxy-N-[2-(2-methoxyethylamino)ethyl]benzamide
CID 82994768
5-chloro-N-[2-(2,2-dimethylpropanoylamino)ethyl]-2-methoxybenzamide
CID 108540892
2,4,5-trimethoxy-N-[2-(4-methoxyphenoxy)ethyl]benzamide
CID 8934968
2-(5-chloro-2-methoxyphenyl)-N-[2-(4-methoxyphenoxy)ethyl]acetamide
CID 8935879
N-[2-(4-chlorophenoxy)ethyl]-3,4,5-trimethoxybenzamide
CID 2295339
N-[2-[(5-chloro-2-methoxybenzoyl)amino]ethyl]-2,3,4-trifluorobenzamide
CID 108540873

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-methoxy-N-[2-[4-(trifluoromethyl)phenoxy]ethyl]benzamide?
The IUPAC name of 5-chloro-2-methoxy-N-[2-[4-(trifluoromethyl)phenoxy]ethyl]benzamide (CID 55803100) is 5-chloro-2-methoxy-N-[2-[4-(trifluoromethyl)phenoxy]ethyl]benzamide.
What is the SMILES notation for 5-chloro-2-methoxy-N-[2-[4-(trifluoromethyl)phenoxy]ethyl]benzamide?
The canonical SMILES for 5-chloro-2-methoxy-N-[2-[4-(trifluoromethyl)phenoxy]ethyl]benzamide is COc1ccc(Cl)cc1C(=O)NCCOc1ccc(C(F)(F)F)cc1.
What is the InChIKey of 5-chloro-2-methoxy-N-[2-[4-(trifluoromethyl)phenoxy]ethyl]benzamide?
The InChIKey is VXVOIORNJBNVEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15ClF3NO3/c1-24-15-7-4-12(18)10-14(15)16(23)22-8-9-25-13-5-2-11(3-6-13)17(19,20)21/h2-7,10H,8-9H2,1H3,(H,22,23).
What are the key properties of 5-chloro-2-methoxy-N-[2-[4-(trifluoromethyl)phenoxy]ethyl]benzamide?
5-chloro-2-methoxy-N-[2-[4-(trifluoromethyl)phenoxy]ethyl]benzamide has a molecular weight of 373.76 g/mol, XLogP of 4.18, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-methoxy-N-[2-[4-(trifluoromethyl)phenoxy]ethyl]benzamide is sourced from PubChem (CID 55803100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).