N,N-diethyl-4-[2-(2-methylanilino)-2-oxoethoxy]benzamide

C20H24N2O3 — CID 18837658

IUPACN,N-diethyl-4-[2-(2-methylanilino)-2-oxoethoxy]benzamide
SMILESCCN(CC)C(=O)c1ccc(OCC(=O)Nc2ccccc2C)cc1
InChIInChI=1S/C20H24N2O3/c1-4-22(5-2)20(24)16-10-12-17(13-11-16)25-14-19(23)21-18-9-7-6-8-15(18)3/h6-13H,4-5,14H2,1-3H3,(H,21,23)
InChIKeyCQXAHOTXNMRHIO-UHFFFAOYSA-N
MW340.42 g/mol
LogP3.49
Rot. Bonds7

About N,N-diethyl-4-[2-(2-methylanilino)-2-oxoethoxy]benzamide

N,N-diethyl-4-[2-(2-methylanilino)-2-oxoethoxy]benzamide (PubChem CID 18837658) has the molecular formula C20H24N2O3 and a molecular weight of 340.42 g/mol. Its IUPAC name is N,N-diethyl-4-[2-(2-methylanilino)-2-oxoethoxy]benzamide.

Molecular Properties

Compound NameN,N-diethyl-4-[2-(2-methylanilino)-2-oxoethoxy]benzamide
PubChem CID18837658
Molecular FormulaC20H24N2O3
Molecular Weight340.42 g/mol
Exact Mass340.18
IUPAC NameN,N-diethyl-4-[2-(2-methylanilino)-2-oxoethoxy]benzamide
SMILESCCN(CC)C(=O)c1ccc(OCC(=O)Nc2ccccc2C)cc1
InChIInChI=1S/C20H24N2O3/c1-4-22(5-2)20(24)16-10-12-17(13-11-16)25-14-19(23)21-18-9-7-6-8-15(18)3/h6-13H,4-5,14H2,1-3H3,(H,21,23)
InChIKeyCQXAHOTXNMRHIO-UHFFFAOYSA-N
XLogP3.49
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.42
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-methylphenoxy)-N-(2-methylphenyl)acetamide
CID 836156
N,N-diethyl-4-[[2-(4-methylphenoxy)acetyl]amino]benzamide
CID 7817272
2-[4-(hydroxymethyl)phenoxy]-N-(2-methylphenyl)acetamide
CID 28561557
N-(2-methylphenyl)-4-[2-oxo-2-[2-(trifluoromethyl)anilino]ethoxy]benzamide
CID 1188045
[2-(2-methylanilino)-2-oxoethyl] 4-(2-amino-2-oxoethoxy)benzoate
CID 8678252
N,N-diethyl-4-[[2-(4-ethylphenoxy)acetyl]amino]benzamide
CID 8503993
N-(2-methylphenyl)-2-(4-nitrophenoxy)acetamide
CID 2787243
2-[[2-(2,6-dimethylphenoxy)acetyl]amino]-N,N-diethylbenzamide
CID 86835516
2-(4-chloro-3-ethylphenoxy)-N-(2-methylphenyl)acetamide
CID 18074792
4-butoxy-N-[2-(2-methylanilino)-2-oxoethyl]benzamide
CID 9342156
N-(2,5-dichlorophenyl)-4-[2-(2-methylanilino)-2-oxoethoxy]benzamide
CID 1179092
N-[(2-methylphenyl)carbamothioyl]-2-[4-[2-[(2-methylphenyl)carbamothioylamino]-2-oxoethoxy]phenoxy]acetamide
CID 3644357

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-4-[2-(2-methylanilino)-2-oxoethoxy]benzamide?
The IUPAC name of N,N-diethyl-4-[2-(2-methylanilino)-2-oxoethoxy]benzamide (CID 18837658) is N,N-diethyl-4-[2-(2-methylanilino)-2-oxoethoxy]benzamide.
What is the SMILES notation for N,N-diethyl-4-[2-(2-methylanilino)-2-oxoethoxy]benzamide?
The canonical SMILES for N,N-diethyl-4-[2-(2-methylanilino)-2-oxoethoxy]benzamide is CCN(CC)C(=O)c1ccc(OCC(=O)Nc2ccccc2C)cc1.
What is the InChIKey of N,N-diethyl-4-[2-(2-methylanilino)-2-oxoethoxy]benzamide?
The InChIKey is CQXAHOTXNMRHIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O3/c1-4-22(5-2)20(24)16-10-12-17(13-11-16)25-14-19(23)21-18-9-7-6-8-15(18)3/h6-13H,4-5,14H2,1-3H3,(H,21,23).
What are the key properties of N,N-diethyl-4-[2-(2-methylanilino)-2-oxoethoxy]benzamide?
N,N-diethyl-4-[2-(2-methylanilino)-2-oxoethoxy]benzamide has a molecular weight of 340.42 g/mol, XLogP of 3.49, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-4-[2-(2-methylanilino)-2-oxoethoxy]benzamide is sourced from PubChem (CID 18837658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).