N-(3-acetamidophenyl)-2-[(4-methoxy-2-methylphenyl)sulfonylamino]acetamide

C18H21N3O5S — CID 112999711

IUPACN-(3-acetamidophenyl)-2-[(4-methoxy-2-methylphenyl)sulfonylamino]acetamide
SMILESCOc1ccc(S(=O)(=O)NCC(=O)Nc2cccc(NC(C)=O)c2)c(C)c1
InChIInChI=1S/C18H21N3O5S/c1-12-9-16(26-3)7-8-17(12)27(24,25)19-11-18(23)21-15-6-4-5-14(10-15)20-13(2)22/h4-10,19H,11H2,1-3H3,(H,20,22)(H,21,23)
InChIKeyQMADUKGNPOWNDH-UHFFFAOYSA-N
MW391.45 g/mol
LogP1.88
Rot. Bonds7

About N-(3-acetamidophenyl)-2-[(4-methoxy-2-methylphenyl)sulfonylamino]acetamide

N-(3-acetamidophenyl)-2-[(4-methoxy-2-methylphenyl)sulfonylamino]acetamide (PubChem CID 112999711) has the molecular formula C18H21N3O5S and a molecular weight of 391.45 g/mol. Its IUPAC name is N-(3-acetamidophenyl)-2-[(4-methoxy-2-methylphenyl)sulfonylamino]acetamide.

Molecular Properties

Compound NameN-(3-acetamidophenyl)-2-[(4-methoxy-2-methylphenyl)sulfonylamino]acetamide
PubChem CID112999711
Molecular FormulaC18H21N3O5S
Molecular Weight391.45 g/mol
Exact Mass391.12
IUPAC NameN-(3-acetamidophenyl)-2-[(4-methoxy-2-methylphenyl)sulfonylamino]acetamide
SMILESCOc1ccc(S(=O)(=O)NCC(=O)Nc2cccc(NC(C)=O)c2)c(C)c1
InChIInChI=1S/C18H21N3O5S/c1-12-9-16(26-3)7-8-17(12)27(24,25)19-11-18(23)21-15-6-4-5-14(10-15)20-13(2)22/h4-10,19H,11H2,1-3H3,(H,20,22)(H,21,23)
InChIKeyQMADUKGNPOWNDH-UHFFFAOYSA-N
XLogP1.88
TPSA113.60 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.45
LogP ≤ 51.88
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3-acetylphenyl)-2-[(4-methoxy-2-methylphenyl)sulfonylamino]acetamide
CID 112999558
N-(3-acetamidophenyl)-2-[(4-methoxyphenyl)sulfonylamino]acetamide
CID 26584175
N-(3-acetamidophenyl)-2-[(2-methylphenyl)sulfonylamino]acetamide
CID 112999723
N-(4-tert-butylphenyl)-2-[(4-methoxy-2-methylphenyl)sulfonylamino]acetamide
CID 112997613
2-[(4-methoxy-2,5-dimethylphenyl)sulfonylamino]-N-(3-methoxyphenyl)acetamide
CID 112998681
2-[(4-acetamidophenyl)sulfonylamino]-N-(3-methoxyphenyl)acetamide
CID 112998688
N-(3-acetamidophenyl)-2-(4-methoxyanilino)acetamide
CID 39453688
methyl 2-[[2-[(4-methoxy-2-methylphenyl)sulfonylamino]acetyl]amino]benzoate
CID 112999849
2-[(4-methoxy-2-methylphenyl)sulfonylamino]-N-[2-(3-methoxyphenyl)ethyl]acetamide
CID 112993591
N-(2-methoxyethyl)-2-[(4-methoxy-2-methylphenyl)sulfonylamino]acetamide
CID 112991177
2-[(2-methoxy-5-methylphenyl)sulfonylamino]-N-(3-methoxyphenyl)acetamide
CID 112998674
2-[(3,4-dimethylphenyl)sulfonylamino]-N-(3-methoxyphenyl)acetamide
CID 112998662

Frequently Asked Questions

What is the IUPAC name of N-(3-acetamidophenyl)-2-[(4-methoxy-2-methylphenyl)sulfonylamino]acetamide?
The IUPAC name of N-(3-acetamidophenyl)-2-[(4-methoxy-2-methylphenyl)sulfonylamino]acetamide (CID 112999711) is N-(3-acetamidophenyl)-2-[(4-methoxy-2-methylphenyl)sulfonylamino]acetamide.
What is the SMILES notation for N-(3-acetamidophenyl)-2-[(4-methoxy-2-methylphenyl)sulfonylamino]acetamide?
The canonical SMILES for N-(3-acetamidophenyl)-2-[(4-methoxy-2-methylphenyl)sulfonylamino]acetamide is COc1ccc(S(=O)(=O)NCC(=O)Nc2cccc(NC(C)=O)c2)c(C)c1.
What is the InChIKey of N-(3-acetamidophenyl)-2-[(4-methoxy-2-methylphenyl)sulfonylamino]acetamide?
The InChIKey is QMADUKGNPOWNDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O5S/c1-12-9-16(26-3)7-8-17(12)27(24,25)19-11-18(23)21-15-6-4-5-14(10-15)20-13(2)22/h4-10,19H,11H2,1-3H3,(H,20,22)(H,21,23).
What are the key properties of N-(3-acetamidophenyl)-2-[(4-methoxy-2-methylphenyl)sulfonylamino]acetamide?
N-(3-acetamidophenyl)-2-[(4-methoxy-2-methylphenyl)sulfonylamino]acetamide has a molecular weight of 391.45 g/mol, XLogP of 1.88, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetamidophenyl)-2-[(4-methoxy-2-methylphenyl)sulfonylamino]acetamide is sourced from PubChem (CID 112999711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).