(2R)-2-acetamido-2-cyclopentyl-N-(2-methylphenyl)sulfonylacetamide

C16H22N2O4S — CID 94186604

IUPAC(2R)-2-acetamido-2-cyclopentyl-N-(2-methylphenyl)sulfonylacetamide
SMILESCC(=O)N[C@@H](C(=O)NS(=O)(=O)c1ccccc1C)C1CCCC1
InChIInChI=1S/C16H22N2O4S/c1-11-7-3-6-10-14(11)23(21,22)18-16(20)15(17-12(2)19)13-8-4-5-9-13/h3,6-7,10,13,15H,4-5,8-9H2,1-2H3,(H,17,19)(H,18,20)/t15-/m1/s1
InChIKeyPRZUVGAMVZITTK-OAHLLOKOSA-N
MW338.43 g/mol
LogP1.49
Rot. Bonds5

About (2R)-2-acetamido-2-cyclopentyl-N-(2-methylphenyl)sulfonylacetamide

(2R)-2-acetamido-2-cyclopentyl-N-(2-methylphenyl)sulfonylacetamide (PubChem CID 94186604) has the molecular formula C16H22N2O4S and a molecular weight of 338.43 g/mol. Its IUPAC name is (2R)-2-acetamido-2-cyclopentyl-N-(2-methylphenyl)sulfonylacetamide.

Molecular Properties

Compound Name(2R)-2-acetamido-2-cyclopentyl-N-(2-methylphenyl)sulfonylacetamide
PubChem CID94186604
Molecular FormulaC16H22N2O4S
Molecular Weight338.43 g/mol
Exact Mass338.13
IUPAC Name(2R)-2-acetamido-2-cyclopentyl-N-(2-methylphenyl)sulfonylacetamide
SMILESCC(=O)N[C@@H](C(=O)NS(=O)(=O)c1ccccc1C)C1CCCC1
InChIInChI=1S/C16H22N2O4S/c1-11-7-3-6-10-14(11)23(21,22)18-16(20)15(17-12(2)19)13-8-4-5-9-13/h3,6-7,10,13,15H,4-5,8-9H2,1-2H3,(H,17,19)(H,18,20)/t15-/m1/s1
InChIKeyPRZUVGAMVZITTK-OAHLLOKOSA-N
XLogP1.49
TPSA92.34 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.43
LogP ≤ 51.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-acetamido-2-cyclopentyl-N-(2-methylphenyl)acetamide
CID 47126825
(2R)-2-acetamido-2-cyclopentyl-N-(4-methoxyphenyl)sulfonylacetamide
CID 94190804
cyclobutane;(2-methylphenyl)sulfonylurea
CID 20975377
2-acetamido-N-(2-chlorophenyl)-2-cyclopentylacetamide
CID 42885299
2-acetamido-2-cyclopentyl-N-(2-phenylethyl)acetamide
CID 51271986
3-cyclopentyl-N-(2-methylphenyl)sulfonylpropanamide
CID 47108856
2-acetamido-2-cyclopentyl-N-(4-methylsulfonylphenyl)acetamide
CID 51272392
(2S)-2-acetamido-2-cyclopentyl-N-(2,4-dimethylphenyl)acetamide
CID 51562307
(2R)-2-acetamido-2-cyclopentyl-N-(2-ethoxyphenyl)acetamide
CID 40938974
(2-methylphenyl)sulfonylurea
CID 20975378
2-acetamido-N-(5-chloro-2-methylphenyl)-2-cyclopentylacetamide
CID 51272260
2-acetamido-N-(4-chloro-2-methylphenyl)-2-cyclopentylacetamide
CID 51272169

Frequently Asked Questions

What is the IUPAC name of (2R)-2-acetamido-2-cyclopentyl-N-(2-methylphenyl)sulfonylacetamide?
The IUPAC name of (2R)-2-acetamido-2-cyclopentyl-N-(2-methylphenyl)sulfonylacetamide (CID 94186604) is (2R)-2-acetamido-2-cyclopentyl-N-(2-methylphenyl)sulfonylacetamide.
What is the SMILES notation for (2R)-2-acetamido-2-cyclopentyl-N-(2-methylphenyl)sulfonylacetamide?
The canonical SMILES for (2R)-2-acetamido-2-cyclopentyl-N-(2-methylphenyl)sulfonylacetamide is CC(=O)N[C@@H](C(=O)NS(=O)(=O)c1ccccc1C)C1CCCC1.
What is the InChIKey of (2R)-2-acetamido-2-cyclopentyl-N-(2-methylphenyl)sulfonylacetamide?
The InChIKey is PRZUVGAMVZITTK-OAHLLOKOSA-N. The full InChI is InChI=1S/C16H22N2O4S/c1-11-7-3-6-10-14(11)23(21,22)18-16(20)15(17-12(2)19)13-8-4-5-9-13/h3,6-7,10,13,15H,4-5,8-9H2,1-2H3,(H,17,19)(H,18,20)/t15-/m1/s1.
What are the key properties of (2R)-2-acetamido-2-cyclopentyl-N-(2-methylphenyl)sulfonylacetamide?
(2R)-2-acetamido-2-cyclopentyl-N-(2-methylphenyl)sulfonylacetamide has a molecular weight of 338.43 g/mol, XLogP of 1.49, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-acetamido-2-cyclopentyl-N-(2-methylphenyl)sulfonylacetamide is sourced from PubChem (CID 94186604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).