N-[2-[(4-methylphenyl)sulfonylamino]ethyl]-N-(2-propan-2-yloxyphenyl)acetamide

C20H26N2O4S — CID 113061066

IUPACN-[2-[(4-methylphenyl)sulfonylamino]ethyl]-N-(2-propan-2-yloxyphenyl)acetamide
SMILESCC(=O)N(CCNS(=O)(=O)c1ccc(C)cc1)c1ccccc1OC(C)C
InChIInChI=1S/C20H26N2O4S/c1-15(2)26-20-8-6-5-7-19(20)22(17(4)23)14-13-21-27(24,25)18-11-9-16(3)10-12-18/h5-12,15,21H,13-14H2,1-4H3
InChIKeyZHBCFKFQJPJMJF-UHFFFAOYSA-N
MW390.51 g/mol
LogP3.11
Rot. Bonds8

About N-[2-[(4-methylphenyl)sulfonylamino]ethyl]-N-(2-propan-2-yloxyphenyl)acetamide

N-[2-[(4-methylphenyl)sulfonylamino]ethyl]-N-(2-propan-2-yloxyphenyl)acetamide (PubChem CID 113061066) has the molecular formula C20H26N2O4S and a molecular weight of 390.51 g/mol. Its IUPAC name is N-[2-[(4-methylphenyl)sulfonylamino]ethyl]-N-(2-propan-2-yloxyphenyl)acetamide.

Molecular Properties

Compound NameN-[2-[(4-methylphenyl)sulfonylamino]ethyl]-N-(2-propan-2-yloxyphenyl)acetamide
PubChem CID113061066
Molecular FormulaC20H26N2O4S
Molecular Weight390.51 g/mol
Exact Mass390.16
IUPAC NameN-[2-[(4-methylphenyl)sulfonylamino]ethyl]-N-(2-propan-2-yloxyphenyl)acetamide
SMILESCC(=O)N(CCNS(=O)(=O)c1ccc(C)cc1)c1ccccc1OC(C)C
InChIInChI=1S/C20H26N2O4S/c1-15(2)26-20-8-6-5-7-19(20)22(17(4)23)14-13-21-27(24,25)18-11-9-16(3)10-12-18/h5-12,15,21H,13-14H2,1-4H3
InChIKeyZHBCFKFQJPJMJF-UHFFFAOYSA-N
XLogP3.11
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.51
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]ethyl]-N-(2-propan-2-yloxyphenyl)acetamide
CID 113061072
N-(2-methylphenyl)-N-[2-[(4-propan-2-ylphenyl)sulfonylamino]ethyl]acetamide
CID 113057370
N-(2,4-dimethoxyphenyl)-N-[2-[(4-methylphenyl)sulfonylamino]ethyl]acetamide
CID 113061279
N-[2-[(4-methylphenyl)sulfonylamino]ethyl]-N-propan-2-ylacetamide
CID 113052047
N-(2,6-difluorophenyl)-N-[2-[(4-methylphenyl)sulfonylamino]ethyl]acetamide
CID 113064563
N-[2-[(4-chlorophenyl)sulfonylamino]ethyl]-N-(2-ethylphenyl)acetamide
CID 113058359
N-(3,4-dimethoxyphenyl)-N-[2-[(4-methylphenyl)sulfonylamino]ethyl]acetamide
CID 113061350
N-[2-(benzenesulfonamido)ethyl]-N-(2,4-dimethoxyphenyl)acetamide
CID 113061278
N-(4-ethylphenyl)-N-[2-[(4-methylphenyl)sulfonylamino]ethyl]acetamide
CID 113058462
3-(N-acetyl-2-propan-2-yloxyanilino)-N-(3-methylbutyl)propanamide
CID 113129740
N-(2-methoxyethyl)-N-[2-[(4-methylphenyl)sulfonylamino]ethyl]acetamide
CID 113053213
N-[2-[(2-chlorophenyl)sulfonylamino]ethyl]-N-(2-methoxyphenyl)acetamide
CID 113060525

Frequently Asked Questions

What is the IUPAC name of N-[2-[(4-methylphenyl)sulfonylamino]ethyl]-N-(2-propan-2-yloxyphenyl)acetamide?
The IUPAC name of N-[2-[(4-methylphenyl)sulfonylamino]ethyl]-N-(2-propan-2-yloxyphenyl)acetamide (CID 113061066) is N-[2-[(4-methylphenyl)sulfonylamino]ethyl]-N-(2-propan-2-yloxyphenyl)acetamide.
What is the SMILES notation for N-[2-[(4-methylphenyl)sulfonylamino]ethyl]-N-(2-propan-2-yloxyphenyl)acetamide?
The canonical SMILES for N-[2-[(4-methylphenyl)sulfonylamino]ethyl]-N-(2-propan-2-yloxyphenyl)acetamide is CC(=O)N(CCNS(=O)(=O)c1ccc(C)cc1)c1ccccc1OC(C)C.
What is the InChIKey of N-[2-[(4-methylphenyl)sulfonylamino]ethyl]-N-(2-propan-2-yloxyphenyl)acetamide?
The InChIKey is ZHBCFKFQJPJMJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O4S/c1-15(2)26-20-8-6-5-7-19(20)22(17(4)23)14-13-21-27(24,25)18-11-9-16(3)10-12-18/h5-12,15,21H,13-14H2,1-4H3.
What are the key properties of N-[2-[(4-methylphenyl)sulfonylamino]ethyl]-N-(2-propan-2-yloxyphenyl)acetamide?
N-[2-[(4-methylphenyl)sulfonylamino]ethyl]-N-(2-propan-2-yloxyphenyl)acetamide has a molecular weight of 390.51 g/mol, XLogP of 3.11, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(4-methylphenyl)sulfonylamino]ethyl]-N-(2-propan-2-yloxyphenyl)acetamide is sourced from PubChem (CID 113061066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).