4-(2-amino-2-oxoethoxy)-N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]benzamide

C19H21FN2O4 — CID 18115738

IUPAC4-(2-amino-2-oxoethoxy)-N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]benzamide
SMILESCCN(Cc1ccc(OC)c(F)c1)C(=O)c1ccc(OCC(N)=O)cc1
InChIInChI=1S/C19H21FN2O4/c1-3-22(11-13-4-9-17(25-2)16(20)10-13)19(24)14-5-7-15(8-6-14)26-12-18(21)23/h4-10H,3,11-12H2,1-2H3,(H2,21,23)
InChIKeyXQLQHZPOQIUNPZ-UHFFFAOYSA-N
MW360.39 g/mol
LogP2.36
Rot. Bonds8

About 4-(2-amino-2-oxoethoxy)-N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]benzamide

4-(2-amino-2-oxoethoxy)-N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]benzamide (PubChem CID 18115738) has the molecular formula C19H21FN2O4 and a molecular weight of 360.39 g/mol. Its IUPAC name is 4-(2-amino-2-oxoethoxy)-N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]benzamide.

Molecular Properties

Compound Name4-(2-amino-2-oxoethoxy)-N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]benzamide
PubChem CID18115738
Molecular FormulaC19H21FN2O4
Molecular Weight360.39 g/mol
Exact Mass360.15
IUPAC Name4-(2-amino-2-oxoethoxy)-N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]benzamide
SMILESCCN(Cc1ccc(OC)c(F)c1)C(=O)c1ccc(OCC(N)=O)cc1
InChIInChI=1S/C19H21FN2O4/c1-3-22(11-13-4-9-17(25-2)16(20)10-13)19(24)14-5-7-15(8-6-14)26-12-18(21)23/h4-10H,3,11-12H2,1-2H3,(H2,21,23)
InChIKeyXQLQHZPOQIUNPZ-UHFFFAOYSA-N
XLogP2.36
TPSA81.86 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.39
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(2-amino-2-oxoethoxy)-N-ethyl-N-[(3-fluorophenyl)methyl]-3-methoxybenzamide
CID 47011435
4-(2-amino-2-oxoethoxy)-N-[(2,6-difluorophenyl)methyl]-N-ethyl-3-methoxybenzamide
CID 119106484
2-amino-N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]acetamide
CID 60712583
3-(difluoromethoxy)-N-ethyl-4-methoxy-N-[(4-methoxyphenyl)methyl]benzamide
CID 55761516
4-chloro-N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]-3-nitrobenzamide
CID 18192640
2-[2-[ethyl-[(3-fluoro-4-methoxyphenyl)methyl]amino]-2-oxoethoxy]-4-methylbenzamide
CID 24600784
N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]furan-2-carboxamide
CID 60652216
4-[(3-fluoro-4-methoxyphenyl)methoxy]benzamide
CID 7893423
4-(2-amino-2-oxoethoxy)-3-chloro-N-[(3,4-dichlorophenyl)methyl]-N-ethyl-5-methoxybenzamide
CID 55916919
2-amino-N,2-diethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]butanamide
CID 79814219
4-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]-N-methylbenzamide
CID 78797061
2-(4-benzoylphenoxy)-N-[(3,4-dimethoxyphenyl)methyl]-N-ethylacetamide
CID 27891131

Frequently Asked Questions

What is the IUPAC name of 4-(2-amino-2-oxoethoxy)-N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]benzamide?
The IUPAC name of 4-(2-amino-2-oxoethoxy)-N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]benzamide (CID 18115738) is 4-(2-amino-2-oxoethoxy)-N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]benzamide.
What is the SMILES notation for 4-(2-amino-2-oxoethoxy)-N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]benzamide?
The canonical SMILES for 4-(2-amino-2-oxoethoxy)-N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]benzamide is CCN(Cc1ccc(OC)c(F)c1)C(=O)c1ccc(OCC(N)=O)cc1.
What is the InChIKey of 4-(2-amino-2-oxoethoxy)-N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]benzamide?
The InChIKey is XQLQHZPOQIUNPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21FN2O4/c1-3-22(11-13-4-9-17(25-2)16(20)10-13)19(24)14-5-7-15(8-6-14)26-12-18(21)23/h4-10H,3,11-12H2,1-2H3,(H2,21,23).
What are the key properties of 4-(2-amino-2-oxoethoxy)-N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]benzamide?
4-(2-amino-2-oxoethoxy)-N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]benzamide has a molecular weight of 360.39 g/mol, XLogP of 2.36, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-amino-2-oxoethoxy)-N-ethyl-N-[(3-fluoro-4-methoxyphenyl)methyl]benzamide is sourced from PubChem (CID 18115738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).