2-(4-chlorophenyl)sulfonyl-N-[2-(dimethylamino)-2-thiophen-2-ylethyl]acetamide

C16H19ClN2O3S2 — CID 18169478

IUPAC2-(4-chlorophenyl)sulfonyl-N-[2-(dimethylamino)-2-thiophen-2-ylethyl]acetamide
SMILESCN(C)C(CNC(=O)CS(=O)(=O)c1ccc(Cl)cc1)c1cccs1
InChIInChI=1S/C16H19ClN2O3S2/c1-19(2)14(15-4-3-9-23-15)10-18-16(20)11-24(21,22)13-7-5-12(17)6-8-13/h3-9,14H,10-11H2,1-2H3,(H,18,20)
InChIKeyOVESIRKSIPCOLQ-UHFFFAOYSA-N
MW386.93 g/mol
LogP2.59
Rot. Bonds7

About 2-(4-chlorophenyl)sulfonyl-N-[2-(dimethylamino)-2-thiophen-2-ylethyl]acetamide

2-(4-chlorophenyl)sulfonyl-N-[2-(dimethylamino)-2-thiophen-2-ylethyl]acetamide (PubChem CID 18169478) has the molecular formula C16H19ClN2O3S2 and a molecular weight of 386.93 g/mol. Its IUPAC name is 2-(4-chlorophenyl)sulfonyl-N-[2-(dimethylamino)-2-thiophen-2-ylethyl]acetamide.

Molecular Properties

Compound Name2-(4-chlorophenyl)sulfonyl-N-[2-(dimethylamino)-2-thiophen-2-ylethyl]acetamide
PubChem CID18169478
Molecular FormulaC16H19ClN2O3S2
Molecular Weight386.93 g/mol
Exact Mass386.05
IUPAC Name2-(4-chlorophenyl)sulfonyl-N-[2-(dimethylamino)-2-thiophen-2-ylethyl]acetamide
SMILESCN(C)C(CNC(=O)CS(=O)(=O)c1ccc(Cl)cc1)c1cccs1
InChIInChI=1S/C16H19ClN2O3S2/c1-19(2)14(15-4-3-9-23-15)10-18-16(20)11-24(21,22)13-7-5-12(17)6-8-13/h3-9,14H,10-11H2,1-2H3,(H,18,20)
InChIKeyOVESIRKSIPCOLQ-UHFFFAOYSA-N
XLogP2.59
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.93
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-chlorophenyl)-N-[(2S)-2-(dimethylamino)-2-thiophen-2-ylethyl]acetamide
CID 30834281
1-(4-chlorophenyl)-3-[2-(dimethylamino)-2-thiophen-2-ylethyl]urea
CID 18588947
N-[(2R)-2-(dimethylamino)-2-thiophen-2-ylethyl]acetamide
CID 51710563
N-[2-(dimethylamino)-2-thiophen-2-ylethyl]butanamide
CID 51072640
3-[[2-(dimethylamino)-2-thiophen-2-ylethyl]amino]-3-oxopropanoic acid
CID 62230106
N-[(2R)-2-(dimethylamino)-2-thiophen-2-ylethyl]-2-[methyl-(4-methylphenyl)sulfonylamino]acetamide
CID 51864935
2-(2,5-dichlorophenoxy)-N-[2-(dimethylamino)-2-thiophen-2-ylethyl]acetamide
CID 18161893
N-[2-(dimethylamino)-2-thiophen-2-ylethyl]-4-hydroxypentanamide
CID 79200485
N-[2-(dimethylamino)-2-thiophen-2-ylethyl]-2-(4-phenylphenyl)acetamide
CID 4807612
2-(tert-butylamino)-N-[2-(dimethylamino)-2-thiophen-2-ylethyl]acetamide
CID 47839911
N-[(2R)-2-(dimethylamino)-2-thiophen-2-ylethyl]-2-(2,5-dioxopyrrolidin-1-yl)acetamide
CID 51895567
2-(2-chlorophenoxy)-N-[2-(dimethylamino)-2-thiophen-2-ylethyl]acetamide
CID 18161769

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)sulfonyl-N-[2-(dimethylamino)-2-thiophen-2-ylethyl]acetamide?
The IUPAC name of 2-(4-chlorophenyl)sulfonyl-N-[2-(dimethylamino)-2-thiophen-2-ylethyl]acetamide (CID 18169478) is 2-(4-chlorophenyl)sulfonyl-N-[2-(dimethylamino)-2-thiophen-2-ylethyl]acetamide.
What is the SMILES notation for 2-(4-chlorophenyl)sulfonyl-N-[2-(dimethylamino)-2-thiophen-2-ylethyl]acetamide?
The canonical SMILES for 2-(4-chlorophenyl)sulfonyl-N-[2-(dimethylamino)-2-thiophen-2-ylethyl]acetamide is CN(C)C(CNC(=O)CS(=O)(=O)c1ccc(Cl)cc1)c1cccs1.
What is the InChIKey of 2-(4-chlorophenyl)sulfonyl-N-[2-(dimethylamino)-2-thiophen-2-ylethyl]acetamide?
The InChIKey is OVESIRKSIPCOLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19ClN2O3S2/c1-19(2)14(15-4-3-9-23-15)10-18-16(20)11-24(21,22)13-7-5-12(17)6-8-13/h3-9,14H,10-11H2,1-2H3,(H,18,20).
What are the key properties of 2-(4-chlorophenyl)sulfonyl-N-[2-(dimethylamino)-2-thiophen-2-ylethyl]acetamide?
2-(4-chlorophenyl)sulfonyl-N-[2-(dimethylamino)-2-thiophen-2-ylethyl]acetamide has a molecular weight of 386.93 g/mol, XLogP of 2.59, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)sulfonyl-N-[2-(dimethylamino)-2-thiophen-2-ylethyl]acetamide is sourced from PubChem (CID 18169478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).