N-(4-acetylphenyl)-2-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)acetamide

C20H22N2O4S — CID 112999633

IUPACN-(4-acetylphenyl)-2-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)acetamide
SMILESCC(=O)c1ccc(NC(=O)CNS(=O)(=O)c2ccc3c(c2)CCCC3)cc1
InChIInChI=1S/C20H22N2O4S/c1-14(23)15-6-9-18(10-7-15)22-20(24)13-21-27(25,26)19-11-8-16-4-2-3-5-17(16)12-19/h6-12,21H,2-5,13H2,1H3,(H,22,24)
InChIKeyLXOQMSJBAWWBPX-UHFFFAOYSA-N
MW386.47 g/mol
LogP2.68
Rot. Bonds6

About N-(4-acetylphenyl)-2-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)acetamide

N-(4-acetylphenyl)-2-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)acetamide (PubChem CID 112999633) has the molecular formula C20H22N2O4S and a molecular weight of 386.47 g/mol. Its IUPAC name is N-(4-acetylphenyl)-2-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)acetamide.

Molecular Properties

Compound NameN-(4-acetylphenyl)-2-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)acetamide
PubChem CID112999633
Molecular FormulaC20H22N2O4S
Molecular Weight386.47 g/mol
Exact Mass386.13
IUPAC NameN-(4-acetylphenyl)-2-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)acetamide
SMILESCC(=O)c1ccc(NC(=O)CNS(=O)(=O)c2ccc3c(c2)CCCC3)cc1
InChIInChI=1S/C20H22N2O4S/c1-14(23)15-6-9-18(10-7-15)22-20(24)13-21-27(25,26)19-11-8-16-4-2-3-5-17(16)12-19/h6-12,21H,2-5,13H2,1H3,(H,22,24)
InChIKeyLXOQMSJBAWWBPX-UHFFFAOYSA-N
XLogP2.68
TPSA92.34 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.47
LogP ≤ 52.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-acetylphenyl)-2-[(4-chlorophenyl)sulfonylamino]acetamide
CID 112999628
4-[3-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)propanoylamino]benzamide
CID 9441800
N-(2,3-dihydro-1H-inden-5-yl)-2-[(4-methoxyphenyl)sulfonylamino]acetamide
CID 24637643
N-(2-methylpropyl)-2-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)acetamide
CID 112990740
(2-anilino-2-oxoethyl) 2-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)acetate
CID 7847645
2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)-N-(2,3-dihydro-1H-inden-5-yl)acetamide
CID 9171843
N-(4-acetylphenyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide
CID 9191578
[2-(4-acetylanilino)-2-oxoethyl] 2-[(3,4-dimethylphenyl)sulfonylamino]acetate
CID 7570282
N-[4-(1-methylimidazole-2-carbonyl)phenyl]-3-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)propanamide
CID 55540409
ethyl 4-[2-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)acetyl]oxybenzoate
CID 9455692
N-(4-acetylphenyl)-2-[(2-methylphenyl)sulfonylamino]acetamide
CID 112999662
N-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-5,6,7,8-tetrahydronaphthalene-2-sulfonamide
CID 110429173

Frequently Asked Questions

What is the IUPAC name of N-(4-acetylphenyl)-2-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)acetamide?
The IUPAC name of N-(4-acetylphenyl)-2-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)acetamide (CID 112999633) is N-(4-acetylphenyl)-2-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)acetamide.
What is the SMILES notation for N-(4-acetylphenyl)-2-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)acetamide?
The canonical SMILES for N-(4-acetylphenyl)-2-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)acetamide is CC(=O)c1ccc(NC(=O)CNS(=O)(=O)c2ccc3c(c2)CCCC3)cc1.
What is the InChIKey of N-(4-acetylphenyl)-2-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)acetamide?
The InChIKey is LXOQMSJBAWWBPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O4S/c1-14(23)15-6-9-18(10-7-15)22-20(24)13-21-27(25,26)19-11-8-16-4-2-3-5-17(16)12-19/h6-12,21H,2-5,13H2,1H3,(H,22,24).
What are the key properties of N-(4-acetylphenyl)-2-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)acetamide?
N-(4-acetylphenyl)-2-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)acetamide has a molecular weight of 386.47 g/mol, XLogP of 2.68, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetylphenyl)-2-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonylamino)acetamide is sourced from PubChem (CID 112999633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).