N-ethyl-N-phenyl-2-(4-propan-2-ylsulfonylphenyl)acetamide

C19H23NO3S — CID 110771447

IUPACN-ethyl-N-phenyl-2-(4-propan-2-ylsulfonylphenyl)acetamide
SMILESCCN(C(=O)Cc1ccc(S(=O)(=O)C(C)C)cc1)c1ccccc1
InChIInChI=1S/C19H23NO3S/c1-4-20(17-8-6-5-7-9-17)19(21)14-16-10-12-18(13-11-16)24(22,23)15(2)3/h5-13,15H,4,14H2,1-3H3
InChIKeyOEWZPBVNPNDRKA-UHFFFAOYSA-N
MW345.46 g/mol
LogP3.46
Rot. Bonds6

About N-ethyl-N-phenyl-2-(4-propan-2-ylsulfonylphenyl)acetamide

N-ethyl-N-phenyl-2-(4-propan-2-ylsulfonylphenyl)acetamide (PubChem CID 110771447) has the molecular formula C19H23NO3S and a molecular weight of 345.46 g/mol. Its IUPAC name is N-ethyl-N-phenyl-2-(4-propan-2-ylsulfonylphenyl)acetamide.

Molecular Properties

Compound NameN-ethyl-N-phenyl-2-(4-propan-2-ylsulfonylphenyl)acetamide
PubChem CID110771447
Molecular FormulaC19H23NO3S
Molecular Weight345.46 g/mol
Exact Mass345.14
IUPAC NameN-ethyl-N-phenyl-2-(4-propan-2-ylsulfonylphenyl)acetamide
SMILESCCN(C(=O)Cc1ccc(S(=O)(=O)C(C)C)cc1)c1ccccc1
InChIInChI=1S/C19H23NO3S/c1-4-20(17-8-6-5-7-9-17)19(21)14-16-10-12-18(13-11-16)24(22,23)15(2)3/h5-13,15H,4,14H2,1-3H3
InChIKeyOEWZPBVNPNDRKA-UHFFFAOYSA-N
XLogP3.46
TPSA54.45 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.46
LogP ≤ 53.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-[2-(N-ethylanilino)-2-oxoethyl]phenyl]-3-phenylpropanamide
CID 55817357
(2S)-2-amino-N-[4-[2-(N-ethylanilino)-2-oxoethyl]phenyl]-4-methylpentanamide
CID 119717943
N,N'-diethyl-N,N'-diphenylpropanediamide
CID 14847934
2-[4-[methyl(phenyl)sulfamoyl]phenyl]acetic acid
CID 43440325
N-(3,5-dimethylphenyl)-N-ethyl-2-phenylacetamide
CID 55592045
2-[4-[ethyl(2-methylpropyl)sulfamoyl]phenyl]acetic acid
CID 43440509
2-(3-bromophenyl)-N-ethyl-N-phenylacetamide
CID 113098483
N-ethyl-N-phenyl-2-(2H-tetrazol-5-yl)acetamide
CID 110498051
N-ethyl-2-[2-hydroxypropyl(propan-2-yl)amino]-N-phenylacetamide
CID 111108185
N-[2-(diethylamino)ethyl]-N-(4-ethyl-1,3-benzothiazol-2-yl)-2-(4-propan-2-ylsulfonylphenyl)acetamide
CID 16838606
N-[(2-methylphenyl)methyl]-2-(4-propan-2-ylsulfonylphenyl)acetamide
CID 110771426
N-ethyl-2-(2-methylphenyl)-N-phenylacetamide
CID 113098481

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-phenyl-2-(4-propan-2-ylsulfonylphenyl)acetamide?
The IUPAC name of N-ethyl-N-phenyl-2-(4-propan-2-ylsulfonylphenyl)acetamide (CID 110771447) is N-ethyl-N-phenyl-2-(4-propan-2-ylsulfonylphenyl)acetamide.
What is the SMILES notation for N-ethyl-N-phenyl-2-(4-propan-2-ylsulfonylphenyl)acetamide?
The canonical SMILES for N-ethyl-N-phenyl-2-(4-propan-2-ylsulfonylphenyl)acetamide is CCN(C(=O)Cc1ccc(S(=O)(=O)C(C)C)cc1)c1ccccc1.
What is the InChIKey of N-ethyl-N-phenyl-2-(4-propan-2-ylsulfonylphenyl)acetamide?
The InChIKey is OEWZPBVNPNDRKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO3S/c1-4-20(17-8-6-5-7-9-17)19(21)14-16-10-12-18(13-11-16)24(22,23)15(2)3/h5-13,15H,4,14H2,1-3H3.
What are the key properties of N-ethyl-N-phenyl-2-(4-propan-2-ylsulfonylphenyl)acetamide?
N-ethyl-N-phenyl-2-(4-propan-2-ylsulfonylphenyl)acetamide has a molecular weight of 345.46 g/mol, XLogP of 3.46, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-phenyl-2-(4-propan-2-ylsulfonylphenyl)acetamide is sourced from PubChem (CID 110771447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).