N-[(2R)-2-(2-chlorophenyl)-2-(diethylamino)ethyl]thiophene-2-sulfonamide

C16H21ClN2O2S2 — CID 26192906

IUPACN-[(2R)-2-(2-chlorophenyl)-2-(diethylamino)ethyl]thiophene-2-sulfonamide
SMILESCCN(CC)[C@@H](CNS(=O)(=O)c1cccs1)c1ccccc1Cl
InChIInChI=1S/C16H21ClN2O2S2/c1-3-19(4-2)15(13-8-5-6-9-14(13)17)12-18-23(20,21)16-10-7-11-22-16/h5-11,15,18H,3-4,12H2,1-2H3/t15-/m0/s1
InChIKeyPQMFBTNNUXNYNT-HNNXBMFYSA-N
MW372.94 g/mol
LogP3.76
Rot. Bonds8

About N-[(2R)-2-(2-chlorophenyl)-2-(diethylamino)ethyl]thiophene-2-sulfonamide

N-[(2R)-2-(2-chlorophenyl)-2-(diethylamino)ethyl]thiophene-2-sulfonamide (PubChem CID 26192906) has the molecular formula C16H21ClN2O2S2 and a molecular weight of 372.94 g/mol. Its IUPAC name is N-[(2R)-2-(2-chlorophenyl)-2-(diethylamino)ethyl]thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-[(2R)-2-(2-chlorophenyl)-2-(diethylamino)ethyl]thiophene-2-sulfonamide
PubChem CID26192906
Molecular FormulaC16H21ClN2O2S2
Molecular Weight372.94 g/mol
Exact Mass372.07
IUPAC NameN-[(2R)-2-(2-chlorophenyl)-2-(diethylamino)ethyl]thiophene-2-sulfonamide
SMILESCCN(CC)[C@@H](CNS(=O)(=O)c1cccs1)c1ccccc1Cl
InChIInChI=1S/C16H21ClN2O2S2/c1-3-19(4-2)15(13-8-5-6-9-14(13)17)12-18-23(20,21)16-10-7-11-22-16/h5-11,15,18H,3-4,12H2,1-2H3/t15-/m0/s1
InChIKeyPQMFBTNNUXNYNT-HNNXBMFYSA-N
XLogP3.76
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.94
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2S)-2-(2-chlorophenyl)-2-methoxyethyl]thiophene-2-sulfonamide
CID 99698254
N-[2-(2-chlorophenyl)-2-(diethylamino)ethyl]butane-1-sulfonamide
CID 60568297
N-[2-(2-chlorophenyl)-2-(diethylamino)ethyl]-4-(2-methoxyethoxy)benzenesulfonamide
CID 43062063
(2R)-N-[(2R)-2-(2-chlorophenyl)-2-(diethylamino)ethyl]-4-methoxybutane-2-sulfonamide
CID 97349330
N-[2-(2-chlorophenyl)-2-(diethylamino)ethyl]-4-methoxy-3-nitrobenzenesulfonamide
CID 16960227
N-(2,2-diphenylethyl)thiophene-2-sulfonamide
CID 4994922
N-[2-(2-methylphenyl)-2-pyrrolidin-1-ylethyl]thiophene-2-sulfonamide
CID 112506471
N-[2-(2-chlorophenyl)-2-(diethylamino)ethyl]-3-[4-(methylsulfamoyl)phenyl]propanamide
CID 46522484
(2R)-2-(2-chlorophenyl)-2-(thiophen-2-ylsulfonylamino)acetic acid
CID 107314977
(2S)-2-(benzenesulfonamido)-N-[2-(2-chlorophenyl)-2-(diethylamino)ethyl]propanamide
CID 55934835
N-[2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]thiophene-2-sulfonamide
CID 47006058
2-phenyl-3-(thiophen-2-ylsulfonylamino)propanoic acid
CID 62882270

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-(2-chlorophenyl)-2-(diethylamino)ethyl]thiophene-2-sulfonamide?
The IUPAC name of N-[(2R)-2-(2-chlorophenyl)-2-(diethylamino)ethyl]thiophene-2-sulfonamide (CID 26192906) is N-[(2R)-2-(2-chlorophenyl)-2-(diethylamino)ethyl]thiophene-2-sulfonamide.
What is the SMILES notation for N-[(2R)-2-(2-chlorophenyl)-2-(diethylamino)ethyl]thiophene-2-sulfonamide?
The canonical SMILES for N-[(2R)-2-(2-chlorophenyl)-2-(diethylamino)ethyl]thiophene-2-sulfonamide is CCN(CC)[C@@H](CNS(=O)(=O)c1cccs1)c1ccccc1Cl.
What is the InChIKey of N-[(2R)-2-(2-chlorophenyl)-2-(diethylamino)ethyl]thiophene-2-sulfonamide?
The InChIKey is PQMFBTNNUXNYNT-HNNXBMFYSA-N. The full InChI is InChI=1S/C16H21ClN2O2S2/c1-3-19(4-2)15(13-8-5-6-9-14(13)17)12-18-23(20,21)16-10-7-11-22-16/h5-11,15,18H,3-4,12H2,1-2H3/t15-/m0/s1.
What are the key properties of N-[(2R)-2-(2-chlorophenyl)-2-(diethylamino)ethyl]thiophene-2-sulfonamide?
N-[(2R)-2-(2-chlorophenyl)-2-(diethylamino)ethyl]thiophene-2-sulfonamide has a molecular weight of 372.94 g/mol, XLogP of 3.76, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-(2-chlorophenyl)-2-(diethylamino)ethyl]thiophene-2-sulfonamide is sourced from PubChem (CID 26192906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).