2-(2-methoxy-N-methylsulfonylanilino)-N-naphthalen-2-ylacetamide

C20H20N2O4S — CID 1326815

IUPAC2-(2-methoxy-N-methylsulfonylanilino)-N-naphthalen-2-ylacetamide
SMILESCOc1ccccc1N(CC(=O)Nc1ccc2ccccc2c1)S(C)(=O)=O
InChIInChI=1S/C20H20N2O4S/c1-26-19-10-6-5-9-18(19)22(27(2,24)25)14-20(23)21-17-12-11-15-7-3-4-8-16(15)13-17/h3-13H,14H2,1-2H3,(H,21,23)
InChIKeyQOOLWOCSDHPQSJ-UHFFFAOYSA-N
MW384.46 g/mol
LogP3.25
Rot. Bonds6

About 2-(2-methoxy-N-methylsulfonylanilino)-N-naphthalen-2-ylacetamide

2-(2-methoxy-N-methylsulfonylanilino)-N-naphthalen-2-ylacetamide (PubChem CID 1326815) has the molecular formula C20H20N2O4S and a molecular weight of 384.46 g/mol. Its IUPAC name is 2-(2-methoxy-N-methylsulfonylanilino)-N-naphthalen-2-ylacetamide.

Molecular Properties

Compound Name2-(2-methoxy-N-methylsulfonylanilino)-N-naphthalen-2-ylacetamide
PubChem CID1326815
Molecular FormulaC20H20N2O4S
Molecular Weight384.46 g/mol
Exact Mass384.11
IUPAC Name2-(2-methoxy-N-methylsulfonylanilino)-N-naphthalen-2-ylacetamide
SMILESCOc1ccccc1N(CC(=O)Nc1ccc2ccccc2c1)S(C)(=O)=O
InChIInChI=1S/C20H20N2O4S/c1-26-19-10-6-5-9-18(19)22(27(2,24)25)14-20(23)21-17-12-11-15-7-3-4-8-16(15)13-17/h3-13H,14H2,1-2H3,(H,21,23)
InChIKeyQOOLWOCSDHPQSJ-UHFFFAOYSA-N
XLogP3.25
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.46
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-methoxy-N-methylsulfonylanilino)-N-(4-methoxyphenyl)acetamide
CID 1334036
2-[N-(benzenesulfonyl)-2-methoxyanilino]-N-naphthalen-2-ylacetamide
CID 1372425
2-(2-methoxy-N-methylsulfonylanilino)-N-(4-propan-2-ylphenyl)acetamide
CID 1321632
N-(4-bromophenyl)-2-(2-methoxy-N-methylsulfonylanilino)acetamide
CID 2290689
N-(3-methoxyphenyl)-2-[methylsulfonyl(naphthalen-1-yl)amino]acetamide
CID 1100140
N-(3,4-dimethoxyphenyl)-2-(2-methyl-N-methylsulfonylanilino)acetamide
CID 3139212
N-(3-chloro-4-methoxyphenyl)-2-(2-methyl-N-methylsulfonylanilino)acetamide
CID 3335724
N-(3-methoxyphenyl)-2-(N-methylsulfonyl-2-propan-2-ylanilino)acetamide
CID 30259702
N-(3,5-dimethoxyphenyl)-2-(2-methyl-N-methylsulfonylanilino)acetamide
CID 8572707
N-(3,4-dimethylphenyl)-2-(2-methoxy-N-(4-methoxyphenyl)sulfonylanilino)acetamide
CID 53280522
2-(N-methylsulfonyl-4-propan-2-ylanilino)-N-naphthalen-2-ylacetamide
CID 30168762
2-(N-methylsulfonyl-4-propan-2-yloxyanilino)-N-naphthalen-2-ylacetamide
CID 30259566

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxy-N-methylsulfonylanilino)-N-naphthalen-2-ylacetamide?
The IUPAC name of 2-(2-methoxy-N-methylsulfonylanilino)-N-naphthalen-2-ylacetamide (CID 1326815) is 2-(2-methoxy-N-methylsulfonylanilino)-N-naphthalen-2-ylacetamide.
What is the SMILES notation for 2-(2-methoxy-N-methylsulfonylanilino)-N-naphthalen-2-ylacetamide?
The canonical SMILES for 2-(2-methoxy-N-methylsulfonylanilino)-N-naphthalen-2-ylacetamide is COc1ccccc1N(CC(=O)Nc1ccc2ccccc2c1)S(C)(=O)=O.
What is the InChIKey of 2-(2-methoxy-N-methylsulfonylanilino)-N-naphthalen-2-ylacetamide?
The InChIKey is QOOLWOCSDHPQSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O4S/c1-26-19-10-6-5-9-18(19)22(27(2,24)25)14-20(23)21-17-12-11-15-7-3-4-8-16(15)13-17/h3-13H,14H2,1-2H3,(H,21,23).
What are the key properties of 2-(2-methoxy-N-methylsulfonylanilino)-N-naphthalen-2-ylacetamide?
2-(2-methoxy-N-methylsulfonylanilino)-N-naphthalen-2-ylacetamide has a molecular weight of 384.46 g/mol, XLogP of 3.25, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxy-N-methylsulfonylanilino)-N-naphthalen-2-ylacetamide is sourced from PubChem (CID 1326815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).