2-phenyl-N-[(1-thiophen-2-ylcyclohexyl)methyl]ethanesulfonamide

C19H25NO2S2 — CID 30943250

IUPAC2-phenyl-N-[(1-thiophen-2-ylcyclohexyl)methyl]ethanesulfonamide
SMILESO=S(=O)(CCc1ccccc1)NCC1(c2cccs2)CCCCC1
InChIInChI=1S/C19H25NO2S2/c21-24(22,15-11-17-8-3-1-4-9-17)20-16-19(12-5-2-6-13-19)18-10-7-14-23-18/h1,3-4,7-10,14,20H,2,5-6,11-13,15-16H2
InChIKeyPCLWADHPZLMIBQ-UHFFFAOYSA-N
MW363.55 g/mol
LogP4.11
Rot. Bonds7

About 2-phenyl-N-[(1-thiophen-2-ylcyclohexyl)methyl]ethanesulfonamide

2-phenyl-N-[(1-thiophen-2-ylcyclohexyl)methyl]ethanesulfonamide (PubChem CID 30943250) has the molecular formula C19H25NO2S2 and a molecular weight of 363.55 g/mol. Its IUPAC name is 2-phenyl-N-[(1-thiophen-2-ylcyclohexyl)methyl]ethanesulfonamide.

Molecular Properties

Compound Name2-phenyl-N-[(1-thiophen-2-ylcyclohexyl)methyl]ethanesulfonamide
PubChem CID30943250
Molecular FormulaC19H25NO2S2
Molecular Weight363.55 g/mol
Exact Mass363.13
IUPAC Name2-phenyl-N-[(1-thiophen-2-ylcyclohexyl)methyl]ethanesulfonamide
SMILESO=S(=O)(CCc1ccccc1)NCC1(c2cccs2)CCCCC1
InChIInChI=1S/C19H25NO2S2/c21-24(22,15-11-17-8-3-1-4-9-17)20-16-19(12-5-2-6-13-19)18-10-7-14-23-18/h1,3-4,7-10,14,20H,2,5-6,11-13,15-16H2
InChIKeyPCLWADHPZLMIBQ-UHFFFAOYSA-N
XLogP4.11
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.55
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-chlorophenyl)-N-[(1-thiophen-2-ylcyclohexyl)methyl]methanesulfonamide
CID 30943309
2-phenyl-N-[(1-thiophen-3-ylcyclopropyl)methyl]ethanesulfonamide
CID 146078875
N-[(1-aminocyclohexyl)methyl]-2-phenylethanesulfonamide;hydrochloride
CID 119958854
2,3,4,5,6-pentamethyl-N-[(1-thiophen-2-ylcyclohexyl)methyl]benzenesulfonamide
CID 30943352
N-[(1-thiophen-2-ylcyclohexyl)methyl]naphthalene-1-sulfonamide
CID 30943313
2,3,5,6-tetramethyl-N-[(1-thiophen-2-ylcyclohexyl)methyl]benzenesulfonamide
CID 30943321
N-[(1-thiophen-2-ylcyclopropyl)methyl]-1-[4-(trifluoromethyl)phenyl]methanesulfonamide
CID 71796611
N-[4-[(1-thiophen-2-ylcyclohexyl)methylsulfamoyl]phenyl]acetamide
CID 30943323
N-[(1-thiophen-2-ylcycloheptyl)methyl]propan-2-amine
CID 55095998
N-[(1-thiophen-2-ylcyclohexyl)methyl]cyclopropanamine
CID 62595162
2,4-dimethoxy-N-[(1-thiophen-2-ylcyclohexyl)methyl]benzenesulfonamide
CID 30943344
N-[1-(hydroxymethyl)cyclohexyl]-2-phenylethanesulfonamide
CID 62519905

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-N-[(1-thiophen-2-ylcyclohexyl)methyl]ethanesulfonamide?
The IUPAC name of 2-phenyl-N-[(1-thiophen-2-ylcyclohexyl)methyl]ethanesulfonamide (CID 30943250) is 2-phenyl-N-[(1-thiophen-2-ylcyclohexyl)methyl]ethanesulfonamide.
What is the SMILES notation for 2-phenyl-N-[(1-thiophen-2-ylcyclohexyl)methyl]ethanesulfonamide?
The canonical SMILES for 2-phenyl-N-[(1-thiophen-2-ylcyclohexyl)methyl]ethanesulfonamide is O=S(=O)(CCc1ccccc1)NCC1(c2cccs2)CCCCC1.
What is the InChIKey of 2-phenyl-N-[(1-thiophen-2-ylcyclohexyl)methyl]ethanesulfonamide?
The InChIKey is PCLWADHPZLMIBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25NO2S2/c21-24(22,15-11-17-8-3-1-4-9-17)20-16-19(12-5-2-6-13-19)18-10-7-14-23-18/h1,3-4,7-10,14,20H,2,5-6,11-13,15-16H2.
What are the key properties of 2-phenyl-N-[(1-thiophen-2-ylcyclohexyl)methyl]ethanesulfonamide?
2-phenyl-N-[(1-thiophen-2-ylcyclohexyl)methyl]ethanesulfonamide has a molecular weight of 363.55 g/mol, XLogP of 4.11, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-N-[(1-thiophen-2-ylcyclohexyl)methyl]ethanesulfonamide is sourced from PubChem (CID 30943250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).