N-[2-(2-ethoxy-N-methylsulfonylanilino)ethyl]-3-methoxybenzamide

C19H24N2O5S — CID 113070559

IUPACN-[2-(2-ethoxy-N-methylsulfonylanilino)ethyl]-3-methoxybenzamide
SMILESCCOc1ccccc1N(CCNC(=O)c1cccc(OC)c1)S(C)(=O)=O
InChIInChI=1S/C19H24N2O5S/c1-4-26-18-11-6-5-10-17(18)21(27(3,23)24)13-12-20-19(22)15-8-7-9-16(14-15)25-2/h5-11,14H,4,12-13H2,1-3H3,(H,20,22)
InChIKeyOIWZNRMJQXLYAK-UHFFFAOYSA-N
MW392.48 g/mol
LogP2.29
Rot. Bonds9

About N-[2-(2-ethoxy-N-methylsulfonylanilino)ethyl]-3-methoxybenzamide

N-[2-(2-ethoxy-N-methylsulfonylanilino)ethyl]-3-methoxybenzamide (PubChem CID 113070559) has the molecular formula C19H24N2O5S and a molecular weight of 392.48 g/mol. Its IUPAC name is N-[2-(2-ethoxy-N-methylsulfonylanilino)ethyl]-3-methoxybenzamide.

Molecular Properties

Compound NameN-[2-(2-ethoxy-N-methylsulfonylanilino)ethyl]-3-methoxybenzamide
PubChem CID113070559
Molecular FormulaC19H24N2O5S
Molecular Weight392.48 g/mol
Exact Mass392.14
IUPAC NameN-[2-(2-ethoxy-N-methylsulfonylanilino)ethyl]-3-methoxybenzamide
SMILESCCOc1ccccc1N(CCNC(=O)c1cccc(OC)c1)S(C)(=O)=O
InChIInChI=1S/C19H24N2O5S/c1-4-26-18-11-6-5-10-17(18)21(27(3,23)24)13-12-20-19(22)15-8-7-9-16(14-15)25-2/h5-11,14H,4,12-13H2,1-3H3,(H,20,22)
InChIKeyOIWZNRMJQXLYAK-UHFFFAOYSA-N
XLogP2.29
TPSA84.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.48
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-methoxy-N-[2-(2-methyl-N-methylsulfonylanilino)ethyl]benzamide
CID 113068540
N-[2-(2-chloro-N-methylsulfonylanilino)ethyl]-3-methoxybenzamide
CID 113069819
N-[2-(2-ethoxy-N-methylsulfonylanilino)ethyl]-2-ethylbutanamide
CID 113070548
3-methoxy-N-[2-[methylsulfonyl(propan-2-yl)amino]ethyl]benzamide
CID 113064974
tert-butyl N-[2-(2-ethoxy-N-methylsulfonylanilino)ethyl]carbamate
CID 113070581
N-[2-[2-(dimethylamino)ethyl-methylsulfonylamino]ethyl]-3-methoxybenzamide
CID 113066241
4-methoxy-N-[2-(3-methoxy-N-methylsulfonylanilino)ethyl]benzamide
CID 113070434
3-methoxy-N-[2-[3-methoxypropyl(methylsulfonyl)amino]ethyl]benzamide
CID 113066070
4-chloro-N-[2-(2-methoxy-N-methylsulfonylanilino)ethyl]benzamide
CID 113070383
4-methoxy-N-[2-(N-methylsulfonyl-2-propan-2-ylanilino)ethyl]benzamide
CID 113069361
3-(2-ethoxy-N-methylsulfonylanilino)-N-(2-methoxyethyl)propanamide
CID 113144790
4-(2-ethoxy-N-methylsulfonylanilino)-N-[1-(ethylamino)-1-oxopropan-2-yl]-N-[(3-methoxyphenyl)methyl]butanamide
CID 132682846

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-ethoxy-N-methylsulfonylanilino)ethyl]-3-methoxybenzamide?
The IUPAC name of N-[2-(2-ethoxy-N-methylsulfonylanilino)ethyl]-3-methoxybenzamide (CID 113070559) is N-[2-(2-ethoxy-N-methylsulfonylanilino)ethyl]-3-methoxybenzamide.
What is the SMILES notation for N-[2-(2-ethoxy-N-methylsulfonylanilino)ethyl]-3-methoxybenzamide?
The canonical SMILES for N-[2-(2-ethoxy-N-methylsulfonylanilino)ethyl]-3-methoxybenzamide is CCOc1ccccc1N(CCNC(=O)c1cccc(OC)c1)S(C)(=O)=O.
What is the InChIKey of N-[2-(2-ethoxy-N-methylsulfonylanilino)ethyl]-3-methoxybenzamide?
The InChIKey is OIWZNRMJQXLYAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O5S/c1-4-26-18-11-6-5-10-17(18)21(27(3,23)24)13-12-20-19(22)15-8-7-9-16(14-15)25-2/h5-11,14H,4,12-13H2,1-3H3,(H,20,22).
What are the key properties of N-[2-(2-ethoxy-N-methylsulfonylanilino)ethyl]-3-methoxybenzamide?
N-[2-(2-ethoxy-N-methylsulfonylanilino)ethyl]-3-methoxybenzamide has a molecular weight of 392.48 g/mol, XLogP of 2.29, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-ethoxy-N-methylsulfonylanilino)ethyl]-3-methoxybenzamide is sourced from PubChem (CID 113070559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).