N-[2-(2-methoxyphenyl)-2-morpholin-4-ylethyl]thiophene-2-sulfonamide

C17H22N2O4S2 — CID 112504149

IUPACN-[2-(2-methoxyphenyl)-2-morpholin-4-ylethyl]thiophene-2-sulfonamide
SMILESCOc1ccccc1C(CNS(=O)(=O)c1cccs1)N1CCOCC1
InChIInChI=1S/C17H22N2O4S2/c1-22-16-6-3-2-5-14(16)15(19-8-10-23-11-9-19)13-18-25(20,21)17-7-4-12-24-17/h2-7,12,15,18H,8-11,13H2,1H3
InChIKeyMHVBJFYEMQUHJP-UHFFFAOYSA-N
MW382.51 g/mol
LogP2.11
Rot. Bonds7

About N-[2-(2-methoxyphenyl)-2-morpholin-4-ylethyl]thiophene-2-sulfonamide

N-[2-(2-methoxyphenyl)-2-morpholin-4-ylethyl]thiophene-2-sulfonamide (PubChem CID 112504149) has the molecular formula C17H22N2O4S2 and a molecular weight of 382.51 g/mol. Its IUPAC name is N-[2-(2-methoxyphenyl)-2-morpholin-4-ylethyl]thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-[2-(2-methoxyphenyl)-2-morpholin-4-ylethyl]thiophene-2-sulfonamide
PubChem CID112504149
Molecular FormulaC17H22N2O4S2
Molecular Weight382.51 g/mol
Exact Mass382.10
IUPAC NameN-[2-(2-methoxyphenyl)-2-morpholin-4-ylethyl]thiophene-2-sulfonamide
SMILESCOc1ccccc1C(CNS(=O)(=O)c1cccs1)N1CCOCC1
InChIInChI=1S/C17H22N2O4S2/c1-22-16-6-3-2-5-14(16)15(19-8-10-23-11-9-19)13-18-25(20,21)17-7-4-12-24-17/h2-7,12,15,18H,8-11,13H2,1H3
InChIKeyMHVBJFYEMQUHJP-UHFFFAOYSA-N
XLogP2.11
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.51
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]thiophene-2-sulfonamide
CID 47006058
N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)thiophene-2-sulfonamide
CID 45003189
4-fluoro-N-[2-(2-methoxyphenyl)-2-morpholin-4-ylethyl]benzenesulfonamide
CID 112504148
N-[2-(2-methylphenyl)-2-pyrrolidin-1-ylethyl]thiophene-2-sulfonamide
CID 112506471
N-[(2R)-2-(3-fluorophenyl)-2-morpholin-4-ylethyl]thiophene-2-sulfonamide
CID 52507194
1-[2-(2-methoxyphenyl)-2-morpholin-4-ylethyl]-3-(2-methylpropyl)urea
CID 110622101
4-fluoro-N-[2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]benzenesulfonamide
CID 47006062
5-bromo-N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]thiophene-2-sulfonamide
CID 43064529
N-[2-(2-methoxyphenyl)-2-morpholin-4-ylethyl]pentanamide
CID 112504087
1-[2-(2-methoxyphenyl)-2-morpholin-4-ylethyl]-3-(3-methylbutyl)urea
CID 110302826
5-bromo-2-methoxy-N-[2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]benzenesulfonamide
CID 134017257
(1-morpholin-4-yl-1-oxopropan-2-yl) 2-(thiophen-2-ylsulfonylamino)acetate
CID 55705049

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-methoxyphenyl)-2-morpholin-4-ylethyl]thiophene-2-sulfonamide?
The IUPAC name of N-[2-(2-methoxyphenyl)-2-morpholin-4-ylethyl]thiophene-2-sulfonamide (CID 112504149) is N-[2-(2-methoxyphenyl)-2-morpholin-4-ylethyl]thiophene-2-sulfonamide.
What is the SMILES notation for N-[2-(2-methoxyphenyl)-2-morpholin-4-ylethyl]thiophene-2-sulfonamide?
The canonical SMILES for N-[2-(2-methoxyphenyl)-2-morpholin-4-ylethyl]thiophene-2-sulfonamide is COc1ccccc1C(CNS(=O)(=O)c1cccs1)N1CCOCC1.
What is the InChIKey of N-[2-(2-methoxyphenyl)-2-morpholin-4-ylethyl]thiophene-2-sulfonamide?
The InChIKey is MHVBJFYEMQUHJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O4S2/c1-22-16-6-3-2-5-14(16)15(19-8-10-23-11-9-19)13-18-25(20,21)17-7-4-12-24-17/h2-7,12,15,18H,8-11,13H2,1H3.
What are the key properties of N-[2-(2-methoxyphenyl)-2-morpholin-4-ylethyl]thiophene-2-sulfonamide?
N-[2-(2-methoxyphenyl)-2-morpholin-4-ylethyl]thiophene-2-sulfonamide has a molecular weight of 382.51 g/mol, XLogP of 2.11, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-methoxyphenyl)-2-morpholin-4-ylethyl]thiophene-2-sulfonamide is sourced from PubChem (CID 112504149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).