2-(2,4-dichlorophenyl)-N-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]acetamide

C16H18Cl2N2OS — CID 32631221

IUPAC2-(2,4-dichlorophenyl)-N-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]acetamide
SMILESCN(C)[C@@H](CNC(=O)Cc1ccc(Cl)cc1Cl)c1ccsc1
InChIInChI=1S/C16H18Cl2N2OS/c1-20(2)15(12-5-6-22-10-12)9-19-16(21)7-11-3-4-13(17)8-14(11)18/h3-6,8,10,15H,7,9H2,1-2H3,(H,19,21)/t15-/m0/s1
InChIKeyDQKSKQFLCPFATM-HNNXBMFYSA-N
MW357.31 g/mol
LogP4.02
Rot. Bonds6

About 2-(2,4-dichlorophenyl)-N-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]acetamide

2-(2,4-dichlorophenyl)-N-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]acetamide (PubChem CID 32631221) has the molecular formula C16H18Cl2N2OS and a molecular weight of 357.31 g/mol. Its IUPAC name is 2-(2,4-dichlorophenyl)-N-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]acetamide.

Molecular Properties

Compound Name2-(2,4-dichlorophenyl)-N-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]acetamide
PubChem CID32631221
Molecular FormulaC16H18Cl2N2OS
Molecular Weight357.31 g/mol
Exact Mass356.05
IUPAC Name2-(2,4-dichlorophenyl)-N-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]acetamide
SMILESCN(C)[C@@H](CNC(=O)Cc1ccc(Cl)cc1Cl)c1ccsc1
InChIInChI=1S/C16H18Cl2N2OS/c1-20(2)15(12-5-6-22-10-12)9-19-16(21)7-11-3-4-13(17)8-14(11)18/h3-6,8,10,15H,7,9H2,1-2H3,(H,19,21)/t15-/m0/s1
InChIKeyDQKSKQFLCPFATM-HNNXBMFYSA-N
XLogP4.02
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.31
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]-2-(2-fluorophenyl)acetamide
CID 32631324
1-(4-chlorophenyl)-3-[2-(dimethylamino)-2-thiophen-3-ylethyl]urea
CID 16931095
5-chloro-N-[2-(dimethylamino)-2-thiophen-3-ylethyl]-1-benzofuran-2-carboxamide
CID 46592179
1-N,4-N-bis[2-(dimethylamino)-2-thiophen-3-ylethyl]benzene-1,4-dicarboxamide
CID 46592184
1-(2-chlorophenyl)-3-[(2S)-2-(dimethylamino)-2-thiophen-3-ylethyl]urea
CID 51896387
N-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]-3,3-diphenylpropanamide
CID 32631467
N-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]-3,5-dimethylbenzamide
CID 42548990
3-[[2-(2,4-dichlorophenyl)acetyl]amino]-2-methylpropanoic acid
CID 62675142
N-[(2S)-2-(dimethylamino)-2-thiophen-3-ylethyl]-2,5-dimethylbenzamide
CID 42549056
2-[4-(difluoromethoxy)phenyl]-N-[2-(dimethylamino)-2-thiophen-3-ylethyl]acetamide
CID 47024523
2-[4-(difluoromethoxy)phenyl]-N-[(2S)-2-(dimethylamino)-2-thiophen-3-ylethyl]acetamide
CID 32632483
N'-[2-(dimethylamino)-2-thiophen-3-ylethyl]-N-ethyloxamide
CID 16932111

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichlorophenyl)-N-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]acetamide?
The IUPAC name of 2-(2,4-dichlorophenyl)-N-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]acetamide (CID 32631221) is 2-(2,4-dichlorophenyl)-N-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]acetamide.
What is the SMILES notation for 2-(2,4-dichlorophenyl)-N-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]acetamide?
The canonical SMILES for 2-(2,4-dichlorophenyl)-N-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]acetamide is CN(C)[C@@H](CNC(=O)Cc1ccc(Cl)cc1Cl)c1ccsc1.
What is the InChIKey of 2-(2,4-dichlorophenyl)-N-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]acetamide?
The InChIKey is DQKSKQFLCPFATM-HNNXBMFYSA-N. The full InChI is InChI=1S/C16H18Cl2N2OS/c1-20(2)15(12-5-6-22-10-12)9-19-16(21)7-11-3-4-13(17)8-14(11)18/h3-6,8,10,15H,7,9H2,1-2H3,(H,19,21)/t15-/m0/s1.
What are the key properties of 2-(2,4-dichlorophenyl)-N-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]acetamide?
2-(2,4-dichlorophenyl)-N-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]acetamide has a molecular weight of 357.31 g/mol, XLogP of 4.02, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichlorophenyl)-N-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]acetamide is sourced from PubChem (CID 32631221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).