4-(methoxymethyl)-N-[2-[4-(trifluoromethyl)phenyl]ethyl]benzamide

C18H18F3NO2 — CID 30843162

IUPAC4-(methoxymethyl)-N-[2-[4-(trifluoromethyl)phenyl]ethyl]benzamide
SMILESCOCc1ccc(C(=O)NCCc2ccc(C(F)(F)F)cc2)cc1
InChIInChI=1S/C18H18F3NO2/c1-24-12-14-2-6-15(7-3-14)17(23)22-11-10-13-4-8-16(9-5-13)18(19,20)21/h2-9H,10-12H2,1H3,(H,22,23)
InChIKeyFRRVSCWMGHUCBD-UHFFFAOYSA-N
MW337.34 g/mol
LogP3.82
Rot. Bonds6

About 4-(methoxymethyl)-N-[2-[4-(trifluoromethyl)phenyl]ethyl]benzamide

4-(methoxymethyl)-N-[2-[4-(trifluoromethyl)phenyl]ethyl]benzamide (PubChem CID 30843162) has the molecular formula C18H18F3NO2 and a molecular weight of 337.34 g/mol. Its IUPAC name is 4-(methoxymethyl)-N-[2-[4-(trifluoromethyl)phenyl]ethyl]benzamide.

Molecular Properties

Compound Name4-(methoxymethyl)-N-[2-[4-(trifluoromethyl)phenyl]ethyl]benzamide
PubChem CID30843162
Molecular FormulaC18H18F3NO2
Molecular Weight337.34 g/mol
Exact Mass337.13
IUPAC Name4-(methoxymethyl)-N-[2-[4-(trifluoromethyl)phenyl]ethyl]benzamide
SMILESCOCc1ccc(C(=O)NCCc2ccc(C(F)(F)F)cc2)cc1
InChIInChI=1S/C18H18F3NO2/c1-24-12-14-2-6-15(7-3-14)17(23)22-11-10-13-4-8-16(9-5-13)18(19,20)21/h2-9H,10-12H2,1H3,(H,22,23)
InChIKeyFRRVSCWMGHUCBD-UHFFFAOYSA-N
XLogP3.82
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.34
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(4-methoxyphenyl)ethyl]-4-(trifluoromethyl)benzamide
CID 2162417
4-(methylsulfamoyl)-N-[2-[4-(trifluoromethyl)phenyl]ethyl]benzamide
CID 27774274
6-methoxy-N-[2-[4-(trifluoromethyl)phenyl]ethyl]pyridine-3-carboxamide
CID 27006412
N-[2-(4-methoxyphenyl)ethyl]-4-(2,2,2-trifluoroethoxymethyl)benzamide
CID 30094922
4-(methoxymethyl)-N-[2-(methylamino)ethyl]benzamide
CID 119503363
4-(methoxymethyl)-N-(2-thiophen-2-ylethyl)benzamide
CID 27770290
1-methoxy-3-[2-[4-(trifluoromethyl)phenyl]ethyl]urea
CID 38212879
4-(methoxymethyl)-N-[2-(4-pyrazol-1-ylphenyl)ethyl]benzamide
CID 26081638
4-(benzenesulfonamido)-N-[2-[4-(trifluoromethyl)phenyl]ethyl]benzamide
CID 31147171
4-N-[2-(4-fluorophenyl)ethyl]-1-N-(3-methoxypropyl)benzene-1,4-dicarboxamide
CID 109045277
N-[2-(1H-pyrrol-3-yl)ethyl]-4-(trifluoromethyl)benzamide
CID 110789374
3,5-bis(trifluoromethyl)-N-[2-(4-trimethylsilyloxyphenyl)ethyl]benzamide
CID 526021

Frequently Asked Questions

What is the IUPAC name of 4-(methoxymethyl)-N-[2-[4-(trifluoromethyl)phenyl]ethyl]benzamide?
The IUPAC name of 4-(methoxymethyl)-N-[2-[4-(trifluoromethyl)phenyl]ethyl]benzamide (CID 30843162) is 4-(methoxymethyl)-N-[2-[4-(trifluoromethyl)phenyl]ethyl]benzamide.
What is the SMILES notation for 4-(methoxymethyl)-N-[2-[4-(trifluoromethyl)phenyl]ethyl]benzamide?
The canonical SMILES for 4-(methoxymethyl)-N-[2-[4-(trifluoromethyl)phenyl]ethyl]benzamide is COCc1ccc(C(=O)NCCc2ccc(C(F)(F)F)cc2)cc1.
What is the InChIKey of 4-(methoxymethyl)-N-[2-[4-(trifluoromethyl)phenyl]ethyl]benzamide?
The InChIKey is FRRVSCWMGHUCBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18F3NO2/c1-24-12-14-2-6-15(7-3-14)17(23)22-11-10-13-4-8-16(9-5-13)18(19,20)21/h2-9H,10-12H2,1H3,(H,22,23).
What are the key properties of 4-(methoxymethyl)-N-[2-[4-(trifluoromethyl)phenyl]ethyl]benzamide?
4-(methoxymethyl)-N-[2-[4-(trifluoromethyl)phenyl]ethyl]benzamide has a molecular weight of 337.34 g/mol, XLogP of 3.82, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methoxymethyl)-N-[2-[4-(trifluoromethyl)phenyl]ethyl]benzamide is sourced from PubChem (CID 30843162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).