N-[2-(2,6-difluoroanilino)-2-oxoethyl]-N-ethyl-3-(methoxymethyl)benzamide

C19H20F2N2O3 — CID 38369967

IUPACN-[2-(2,6-difluoroanilino)-2-oxoethyl]-N-ethyl-3-(methoxymethyl)benzamide
SMILESCCN(CC(=O)Nc1c(F)cccc1F)C(=O)c1cccc(COC)c1
InChIInChI=1S/C19H20F2N2O3/c1-3-23(19(25)14-7-4-6-13(10-14)12-26-2)11-17(24)22-18-15(20)8-5-9-16(18)21/h4-10H,3,11-12H2,1-2H3,(H,22,24)
InChIKeyVRPJTJPQAACZIG-UHFFFAOYSA-N
MW362.38 g/mol
LogP3.21
Rot. Bonds7

About N-[2-(2,6-difluoroanilino)-2-oxoethyl]-N-ethyl-3-(methoxymethyl)benzamide

N-[2-(2,6-difluoroanilino)-2-oxoethyl]-N-ethyl-3-(methoxymethyl)benzamide (PubChem CID 38369967) has the molecular formula C19H20F2N2O3 and a molecular weight of 362.38 g/mol. Its IUPAC name is N-[2-(2,6-difluoroanilino)-2-oxoethyl]-N-ethyl-3-(methoxymethyl)benzamide.

Molecular Properties

Compound NameN-[2-(2,6-difluoroanilino)-2-oxoethyl]-N-ethyl-3-(methoxymethyl)benzamide
PubChem CID38369967
Molecular FormulaC19H20F2N2O3
Molecular Weight362.38 g/mol
Exact Mass362.14
IUPAC NameN-[2-(2,6-difluoroanilino)-2-oxoethyl]-N-ethyl-3-(methoxymethyl)benzamide
SMILESCCN(CC(=O)Nc1c(F)cccc1F)C(=O)c1cccc(COC)c1
InChIInChI=1S/C19H20F2N2O3/c1-3-23(19(25)14-7-4-6-13(10-14)12-26-2)11-17(24)22-18-15(20)8-5-9-16(18)21/h4-10H,3,11-12H2,1-2H3,(H,22,24)
InChIKeyVRPJTJPQAACZIG-UHFFFAOYSA-N
XLogP3.21
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.38
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[ethyl-[3-(methoxymethyl)benzoyl]amino]acetic acid
CID 54901381
N-[2-(2,6-difluoroanilino)-2-oxoethyl]-N-ethyl-3-[methyl(phenyl)sulfamoyl]benzamide
CID 24982037
2,5-dichloro-N-[2-(2,6-difluoroanilino)-2-oxoethyl]-N-ethylbenzamide
CID 38369368
N-[2-(2,6-difluoroanilino)-2-oxoethyl]-N-ethyl-5-(2-fluorophenyl)furan-2-carboxamide
CID 46562764
3-amino-N-[2-(2,6-difluoroanilino)-2-oxoethyl]-N-ethylpropanamide
CID 119266607
N-[2-(2,6-difluoroanilino)-2-oxoethyl]-N-ethyl-4-[ethyl(phenyl)sulfamoyl]benzamide
CID 25163577
ethyl 3-[[2-(2,6-difluoroanilino)-2-oxoethyl]-ethylcarbamoyl]-5-nitrobenzoate
CID 38564020
N,N-dibenzyl-3-(methoxymethyl)benzamide
CID 55436683
N-[2-(2,6-difluoroanilino)-2-oxoethyl]-N-ethyl-4-piperidin-1-ylsulfonylbenzamide
CID 24979798
N-[2-[[2-(2,6-difluoroanilino)-2-oxoethyl]-ethylamino]-2-oxoethyl]-3-(difluoromethoxy)benzamide
CID 30794603
N-[2-[[2-(2,6-difluoroanilino)-2-oxoethyl]-ethylamino]-2-oxoethyl]-3,4,5-trimethoxybenzamide
CID 38370231
N-[2-(2,6-difluoroanilino)-2-oxoethyl]-4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-ethylbenzamide
CID 25161960

Frequently Asked Questions

What is the IUPAC name of N-[2-(2,6-difluoroanilino)-2-oxoethyl]-N-ethyl-3-(methoxymethyl)benzamide?
The IUPAC name of N-[2-(2,6-difluoroanilino)-2-oxoethyl]-N-ethyl-3-(methoxymethyl)benzamide (CID 38369967) is N-[2-(2,6-difluoroanilino)-2-oxoethyl]-N-ethyl-3-(methoxymethyl)benzamide.
What is the SMILES notation for N-[2-(2,6-difluoroanilino)-2-oxoethyl]-N-ethyl-3-(methoxymethyl)benzamide?
The canonical SMILES for N-[2-(2,6-difluoroanilino)-2-oxoethyl]-N-ethyl-3-(methoxymethyl)benzamide is CCN(CC(=O)Nc1c(F)cccc1F)C(=O)c1cccc(COC)c1.
What is the InChIKey of N-[2-(2,6-difluoroanilino)-2-oxoethyl]-N-ethyl-3-(methoxymethyl)benzamide?
The InChIKey is VRPJTJPQAACZIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20F2N2O3/c1-3-23(19(25)14-7-4-6-13(10-14)12-26-2)11-17(24)22-18-15(20)8-5-9-16(18)21/h4-10H,3,11-12H2,1-2H3,(H,22,24).
What are the key properties of N-[2-(2,6-difluoroanilino)-2-oxoethyl]-N-ethyl-3-(methoxymethyl)benzamide?
N-[2-(2,6-difluoroanilino)-2-oxoethyl]-N-ethyl-3-(methoxymethyl)benzamide has a molecular weight of 362.38 g/mol, XLogP of 3.21, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,6-difluoroanilino)-2-oxoethyl]-N-ethyl-3-(methoxymethyl)benzamide is sourced from PubChem (CID 38369967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).