N-[2-[2-(2,6-difluorophenyl)ethylamino]-2-oxoethyl]-4-ethoxybenzamide

C19H20F2N2O3 — CID 60547662

IUPACN-[2-[2-(2,6-difluorophenyl)ethylamino]-2-oxoethyl]-4-ethoxybenzamide
SMILESCCOc1ccc(C(=O)NCC(=O)NCCc2c(F)cccc2F)cc1
InChIInChI=1S/C19H20F2N2O3/c1-2-26-14-8-6-13(7-9-14)19(25)23-12-18(24)22-11-10-15-16(20)4-3-5-17(15)21/h3-9H,2,10-12H2,1H3,(H,22,24)(H,23,25)
InChIKeyDVPDZSLALZAWGS-UHFFFAOYSA-N
MW362.38 g/mol
LogP2.45
Rot. Bonds8

About N-[2-[2-(2,6-difluorophenyl)ethylamino]-2-oxoethyl]-4-ethoxybenzamide

N-[2-[2-(2,6-difluorophenyl)ethylamino]-2-oxoethyl]-4-ethoxybenzamide (PubChem CID 60547662) has the molecular formula C19H20F2N2O3 and a molecular weight of 362.38 g/mol. Its IUPAC name is N-[2-[2-(2,6-difluorophenyl)ethylamino]-2-oxoethyl]-4-ethoxybenzamide.

Molecular Properties

Compound NameN-[2-[2-(2,6-difluorophenyl)ethylamino]-2-oxoethyl]-4-ethoxybenzamide
PubChem CID60547662
Molecular FormulaC19H20F2N2O3
Molecular Weight362.38 g/mol
Exact Mass362.14
IUPAC NameN-[2-[2-(2,6-difluorophenyl)ethylamino]-2-oxoethyl]-4-ethoxybenzamide
SMILESCCOc1ccc(C(=O)NCC(=O)NCCc2c(F)cccc2F)cc1
InChIInChI=1S/C19H20F2N2O3/c1-2-26-14-8-6-13(7-9-14)19(25)23-12-18(24)22-11-10-15-16(20)4-3-5-17(15)21/h3-9H,2,10-12H2,1H3,(H,22,24)(H,23,25)
InChIKeyDVPDZSLALZAWGS-UHFFFAOYSA-N
XLogP2.45
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.38
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-[2-(3-bromo-4-fluorophenyl)ethylamino]-2-oxoethyl]-4-ethoxybenzamide
CID 60552806
N-[2-(butylamino)-2-oxoethyl]-4-ethoxybenzamide
CID 34231237
3-[2-[[2-[(4-ethoxybenzoyl)amino]acetyl]amino]ethyl]benzoic acid
CID 120535479
4-ethoxy-N-[2-oxo-2-(2-thiophen-2-ylethylamino)ethyl]benzamide
CID 27770384
4-chloro-N-[2-[2-(4-ethoxyphenoxy)ethylamino]-2-oxoethyl]benzamide
CID 9022553
N-[2-[2-[[2-(4-ethoxyphenyl)acetyl]amino]ethylamino]-2-oxoethyl]benzamide
CID 108539279
4-ethoxy-N-[2-[2-(4-methylphenoxy)ethylamino]-2-oxoethyl]benzamide
CID 9366137
4-ethoxy-N-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]benzamide
CID 51166561
N-[2-[[2-(2,6-dimethylanilino)-2-oxoethyl]amino]-2-oxoethyl]-4-ethoxybenzamide
CID 7676792
4-ethoxy-N-[2-(3-fluoroanilino)-2-oxoethyl]benzamide
CID 9412541
4-ethoxy-N-(2-hydrazinyl-2-oxoethyl)benzamide
CID 17349908
4-ethoxy-N-[2-[2-(N-methylanilino)ethylamino]-2-oxoethyl]benzamide
CID 25396160

Frequently Asked Questions

What is the IUPAC name of N-[2-[2-(2,6-difluorophenyl)ethylamino]-2-oxoethyl]-4-ethoxybenzamide?
The IUPAC name of N-[2-[2-(2,6-difluorophenyl)ethylamino]-2-oxoethyl]-4-ethoxybenzamide (CID 60547662) is N-[2-[2-(2,6-difluorophenyl)ethylamino]-2-oxoethyl]-4-ethoxybenzamide.
What is the SMILES notation for N-[2-[2-(2,6-difluorophenyl)ethylamino]-2-oxoethyl]-4-ethoxybenzamide?
The canonical SMILES for N-[2-[2-(2,6-difluorophenyl)ethylamino]-2-oxoethyl]-4-ethoxybenzamide is CCOc1ccc(C(=O)NCC(=O)NCCc2c(F)cccc2F)cc1.
What is the InChIKey of N-[2-[2-(2,6-difluorophenyl)ethylamino]-2-oxoethyl]-4-ethoxybenzamide?
The InChIKey is DVPDZSLALZAWGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20F2N2O3/c1-2-26-14-8-6-13(7-9-14)19(25)23-12-18(24)22-11-10-15-16(20)4-3-5-17(15)21/h3-9H,2,10-12H2,1H3,(H,22,24)(H,23,25).
What are the key properties of N-[2-[2-(2,6-difluorophenyl)ethylamino]-2-oxoethyl]-4-ethoxybenzamide?
N-[2-[2-(2,6-difluorophenyl)ethylamino]-2-oxoethyl]-4-ethoxybenzamide has a molecular weight of 362.38 g/mol, XLogP of 2.45, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-(2,6-difluorophenyl)ethylamino]-2-oxoethyl]-4-ethoxybenzamide is sourced from PubChem (CID 60547662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).