N-[4-(ethylsulfonylamino)phenyl]-2-naphthalen-2-ylacetamide

C20H20N2O3S — CID 47067033

IUPACN-[4-(ethylsulfonylamino)phenyl]-2-naphthalen-2-ylacetamide
SMILESCCS(=O)(=O)Nc1ccc(NC(=O)Cc2ccc3ccccc3c2)cc1
InChIInChI=1S/C20H20N2O3S/c1-2-26(24,25)22-19-11-9-18(10-12-19)21-20(23)14-15-7-8-16-5-3-4-6-17(16)13-15/h3-13,22H,2,14H2,1H3,(H,21,23)
InChIKeyBLJOUZAOGLUHFT-UHFFFAOYSA-N
MW368.46 g/mol
LogP3.78
Rot. Bonds6

About N-[4-(ethylsulfonylamino)phenyl]-2-naphthalen-2-ylacetamide

N-[4-(ethylsulfonylamino)phenyl]-2-naphthalen-2-ylacetamide (PubChem CID 47067033) has the molecular formula C20H20N2O3S and a molecular weight of 368.46 g/mol. Its IUPAC name is N-[4-(ethylsulfonylamino)phenyl]-2-naphthalen-2-ylacetamide.

Molecular Properties

Compound NameN-[4-(ethylsulfonylamino)phenyl]-2-naphthalen-2-ylacetamide
PubChem CID47067033
Molecular FormulaC20H20N2O3S
Molecular Weight368.46 g/mol
Exact Mass368.12
IUPAC NameN-[4-(ethylsulfonylamino)phenyl]-2-naphthalen-2-ylacetamide
SMILESCCS(=O)(=O)Nc1ccc(NC(=O)Cc2ccc3ccccc3c2)cc1
InChIInChI=1S/C20H20N2O3S/c1-2-26(24,25)22-19-11-9-18(10-12-19)21-20(23)14-15-7-8-16-5-3-4-6-17(16)13-15/h3-13,22H,2,14H2,1H3,(H,21,23)
InChIKeyBLJOUZAOGLUHFT-UHFFFAOYSA-N
XLogP3.78
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.46
LogP ≤ 53.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-acetamidophenyl)-2-naphthalen-2-ylacetamide
CID 26499620
N-(4-methylphenyl)-2-naphthalen-2-ylacetamide
CID 9411639
N-(4-ethoxyphenyl)-2-naphthalen-2-ylacetamide
CID 2992988
N-[3,5-bis[(2-naphthalen-2-ylacetyl)amino]phenyl]-2-naphthalen-2-ylacetamide
CID 67257199
N-(4-acetylphenyl)-2-naphthalen-2-ylacetamide
CID 16849660
2-[4-[(2-naphthalen-2-ylacetyl)amino]phenyl]acetic acid
CID 6461297
2-naphthalen-2-yl-N-[4-(propan-2-ylcarbamoylamino)phenyl]acetamide
CID 38196427
2-naphthalen-2-yl-N-pyridin-4-ylacetamide
CID 25336159
N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]-2-naphthalen-2-ylacetamide
CID 53255376
2-naphthalen-2-yl-N-[4-(trifluoromethoxy)phenyl]acetamide
CID 18277342
N-(3-acetylphenyl)-2-naphthalen-2-ylacetamide
CID 9165110
2-naphthalen-2-yl-N-[4-(3,4,5,6-tetrahydro-2H-azepin-7-ylsulfamoyl)phenyl]acetamide
CID 26267039

Frequently Asked Questions

What is the IUPAC name of N-[4-(ethylsulfonylamino)phenyl]-2-naphthalen-2-ylacetamide?
The IUPAC name of N-[4-(ethylsulfonylamino)phenyl]-2-naphthalen-2-ylacetamide (CID 47067033) is N-[4-(ethylsulfonylamino)phenyl]-2-naphthalen-2-ylacetamide.
What is the SMILES notation for N-[4-(ethylsulfonylamino)phenyl]-2-naphthalen-2-ylacetamide?
The canonical SMILES for N-[4-(ethylsulfonylamino)phenyl]-2-naphthalen-2-ylacetamide is CCS(=O)(=O)Nc1ccc(NC(=O)Cc2ccc3ccccc3c2)cc1.
What is the InChIKey of N-[4-(ethylsulfonylamino)phenyl]-2-naphthalen-2-ylacetamide?
The InChIKey is BLJOUZAOGLUHFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O3S/c1-2-26(24,25)22-19-11-9-18(10-12-19)21-20(23)14-15-7-8-16-5-3-4-6-17(16)13-15/h3-13,22H,2,14H2,1H3,(H,21,23).
What are the key properties of N-[4-(ethylsulfonylamino)phenyl]-2-naphthalen-2-ylacetamide?
N-[4-(ethylsulfonylamino)phenyl]-2-naphthalen-2-ylacetamide has a molecular weight of 368.46 g/mol, XLogP of 3.78, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(ethylsulfonylamino)phenyl]-2-naphthalen-2-ylacetamide is sourced from PubChem (CID 47067033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).