N-(3,5-dimethoxyphenyl)sulfonyl-2-(4-methylphenyl)acetamide

C17H19NO5S — CID 166234668

IUPACN-(3,5-dimethoxyphenyl)sulfonyl-2-(4-methylphenyl)acetamide
SMILESCOc1cc(OC)cc(S(=O)(=O)NC(=O)Cc2ccc(C)cc2)c1
InChIInChI=1S/C17H19NO5S/c1-12-4-6-13(7-5-12)8-17(19)18-24(20,21)16-10-14(22-2)9-15(11-16)23-3/h4-7,9-11H,8H2,1-3H3,(H,18,19)
InChIKeyZUZNYAXVFOWXMH-UHFFFAOYSA-N
MW349.41 g/mol
LogP2.06
Rot. Bonds6

About N-(3,5-dimethoxyphenyl)sulfonyl-2-(4-methylphenyl)acetamide

N-(3,5-dimethoxyphenyl)sulfonyl-2-(4-methylphenyl)acetamide (PubChem CID 166234668) has the molecular formula C17H19NO5S and a molecular weight of 349.41 g/mol. Its IUPAC name is N-(3,5-dimethoxyphenyl)sulfonyl-2-(4-methylphenyl)acetamide.

Molecular Properties

Compound NameN-(3,5-dimethoxyphenyl)sulfonyl-2-(4-methylphenyl)acetamide
PubChem CID166234668
Molecular FormulaC17H19NO5S
Molecular Weight349.41 g/mol
Exact Mass349.10
IUPAC NameN-(3,5-dimethoxyphenyl)sulfonyl-2-(4-methylphenyl)acetamide
SMILESCOc1cc(OC)cc(S(=O)(=O)NC(=O)Cc2ccc(C)cc2)c1
InChIInChI=1S/C17H19NO5S/c1-12-4-6-13(7-5-12)8-17(19)18-24(20,21)16-10-14(22-2)9-15(11-16)23-3/h4-7,9-11H,8H2,1-3H3,(H,18,19)
InChIKeyZUZNYAXVFOWXMH-UHFFFAOYSA-N
XLogP2.06
TPSA81.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.41
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(benzenesulfonyl)-2-(3-methoxyphenyl)acetamide
CID 139754173
2-(4-methoxyphenyl)-N-[(4-methylphenyl)methyl]acetamide;hydrochloride
CID 142729709
N-(3-bromo-4-methoxyphenyl)sulfonyl-2-(4-chlorophenyl)acetamide
CID 166199698
N-(4-methoxy-2-methylphenyl)-2-(4-methylphenyl)acetamide
CID 17087411
N-(4-methylphenyl)sulfonyl-2-thiophen-3-ylacetamide
CID 101377782
3,5-dimethoxy-N-[(4-methylphenyl)methyl]benzamide
CID 835462
1-[4-(3,5-dimethoxybenzoyl)piperazin-1-yl]-2-(4-methylphenyl)ethanone
CID 32824583
2-(4-fluorophenyl)-N-(4-fluorophenyl)sulfonylacetamide
CID 56683687
N-(benzenesulfonyl)-N'-(4-methylphenyl)sulfonylpropanediamide
CID 135051885
N-(2-amino-2-oxoethyl)sulfonyl-2-(4-methoxyphenyl)acetamide
CID 166210769
N-(4-methoxyphenyl)sulfonyl-2-(5-methyl-2-phenylpyrazol-3-yl)acetamide
CID 11545489
N-(4-chlorophenyl)sulfonyl-2-(4-ethoxyphenyl)acetamide
CID 166208857

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethoxyphenyl)sulfonyl-2-(4-methylphenyl)acetamide?
The IUPAC name of N-(3,5-dimethoxyphenyl)sulfonyl-2-(4-methylphenyl)acetamide (CID 166234668) is N-(3,5-dimethoxyphenyl)sulfonyl-2-(4-methylphenyl)acetamide.
What is the SMILES notation for N-(3,5-dimethoxyphenyl)sulfonyl-2-(4-methylphenyl)acetamide?
The canonical SMILES for N-(3,5-dimethoxyphenyl)sulfonyl-2-(4-methylphenyl)acetamide is COc1cc(OC)cc(S(=O)(=O)NC(=O)Cc2ccc(C)cc2)c1.
What is the InChIKey of N-(3,5-dimethoxyphenyl)sulfonyl-2-(4-methylphenyl)acetamide?
The InChIKey is ZUZNYAXVFOWXMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO5S/c1-12-4-6-13(7-5-12)8-17(19)18-24(20,21)16-10-14(22-2)9-15(11-16)23-3/h4-7,9-11H,8H2,1-3H3,(H,18,19).
What are the key properties of N-(3,5-dimethoxyphenyl)sulfonyl-2-(4-methylphenyl)acetamide?
N-(3,5-dimethoxyphenyl)sulfonyl-2-(4-methylphenyl)acetamide has a molecular weight of 349.41 g/mol, XLogP of 2.06, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethoxyphenyl)sulfonyl-2-(4-methylphenyl)acetamide is sourced from PubChem (CID 166234668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).