2-methoxy-N-[2-[methylsulfonyl(2-phenylethyl)amino]ethyl]benzamide

C19H24N2O4S — CID 113067504

IUPAC2-methoxy-N-[2-[methylsulfonyl(2-phenylethyl)amino]ethyl]benzamide
SMILESCOc1ccccc1C(=O)NCCN(CCc1ccccc1)S(C)(=O)=O
InChIInChI=1S/C19H24N2O4S/c1-25-18-11-7-6-10-17(18)19(22)20-13-15-21(26(2,23)24)14-12-16-8-4-3-5-9-16/h3-11H,12-15H2,1-2H3,(H,20,22)
InChIKeySOTRGXROOAKLQI-UHFFFAOYSA-N
MW376.48 g/mol
LogP1.93
Rot. Bonds9

About 2-methoxy-N-[2-[methylsulfonyl(2-phenylethyl)amino]ethyl]benzamide

2-methoxy-N-[2-[methylsulfonyl(2-phenylethyl)amino]ethyl]benzamide (PubChem CID 113067504) has the molecular formula C19H24N2O4S and a molecular weight of 376.48 g/mol. Its IUPAC name is 2-methoxy-N-[2-[methylsulfonyl(2-phenylethyl)amino]ethyl]benzamide.

Molecular Properties

Compound Name2-methoxy-N-[2-[methylsulfonyl(2-phenylethyl)amino]ethyl]benzamide
PubChem CID113067504
Molecular FormulaC19H24N2O4S
Molecular Weight376.48 g/mol
Exact Mass376.15
IUPAC Name2-methoxy-N-[2-[methylsulfonyl(2-phenylethyl)amino]ethyl]benzamide
SMILESCOc1ccccc1C(=O)NCCN(CCc1ccccc1)S(C)(=O)=O
InChIInChI=1S/C19H24N2O4S/c1-25-18-11-7-6-10-17(18)19(22)20-13-15-21(26(2,23)24)14-12-16-8-4-3-5-9-16/h3-11H,12-15H2,1-2H3,(H,20,22)
InChIKeySOTRGXROOAKLQI-UHFFFAOYSA-N
XLogP1.93
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.48
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-N-[2-[methylsulfonyl(2-phenylethyl)amino]ethyl]benzamide
CID 113067498
N-[2-[2-(2-methoxyphenyl)ethyl-methylsulfonylamino]ethyl]furan-2-carboxamide
CID 113067658
2-methoxy-N-[2-(4-methyl-N-methylsulfonylanilino)ethyl]benzamide
CID 113068703
2-methoxy-N-(2-methylsulfonylethyl)benzamide
CID 47230081
N-[3-[benzyl(methyl)amino]propyl]-2-methoxybenzamide
CID 18118649
N-[2-[benzyl(methylsulfonyl)amino]ethyl]-2-fluorobenzamide
CID 113066552
N-[2-[2-(2-methoxyphenyl)ethyl-methylsulfonylamino]ethyl]propanamide
CID 113067650
2-[4-[2-[(2-methoxybenzoyl)amino]ethyl]phenyl]acetic acid
CID 23453032
3-[methylsulfonyl(2-phenylethyl)amino]propanoic acid
CID 82326336
3-methoxy-2-[(2-methoxybenzoyl)amino]-N-(2-phenylethyl)benzamide
CID 118913463
N-[2-[2-(3-chlorophenyl)ethyl-methylsulfonylamino]ethyl]benzamide
CID 113068381
2-(4-methylphenyl)-N-[2-[methylsulfonyl(3-phenylpropyl)amino]ethyl]acetamide
CID 113067963

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[2-[methylsulfonyl(2-phenylethyl)amino]ethyl]benzamide?
The IUPAC name of 2-methoxy-N-[2-[methylsulfonyl(2-phenylethyl)amino]ethyl]benzamide (CID 113067504) is 2-methoxy-N-[2-[methylsulfonyl(2-phenylethyl)amino]ethyl]benzamide.
What is the SMILES notation for 2-methoxy-N-[2-[methylsulfonyl(2-phenylethyl)amino]ethyl]benzamide?
The canonical SMILES for 2-methoxy-N-[2-[methylsulfonyl(2-phenylethyl)amino]ethyl]benzamide is COc1ccccc1C(=O)NCCN(CCc1ccccc1)S(C)(=O)=O.
What is the InChIKey of 2-methoxy-N-[2-[methylsulfonyl(2-phenylethyl)amino]ethyl]benzamide?
The InChIKey is SOTRGXROOAKLQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O4S/c1-25-18-11-7-6-10-17(18)19(22)20-13-15-21(26(2,23)24)14-12-16-8-4-3-5-9-16/h3-11H,12-15H2,1-2H3,(H,20,22).
What are the key properties of 2-methoxy-N-[2-[methylsulfonyl(2-phenylethyl)amino]ethyl]benzamide?
2-methoxy-N-[2-[methylsulfonyl(2-phenylethyl)amino]ethyl]benzamide has a molecular weight of 376.48 g/mol, XLogP of 1.93, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[2-[methylsulfonyl(2-phenylethyl)amino]ethyl]benzamide is sourced from PubChem (CID 113067504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).