N-(2-methylcyclohexyl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide

C17H26N2O4S2 — CID 24982672

IUPACN-(2-methylcyclohexyl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide
SMILESCC1CCCCC1NC(=O)Cc1ccc(S(=O)(=O)N2CCOCC2)s1
InChIInChI=1S/C17H26N2O4S2/c1-13-4-2-3-5-15(13)18-16(20)12-14-6-7-17(24-14)25(21,22)19-8-10-23-11-9-19/h6-7,13,15H,2-5,8-12H2,1H3,(H,18,20)
InChIKeyGRUMRMUJKYBQDM-UHFFFAOYSA-N
MW386.54 g/mol
LogP2.01
Rot. Bonds5

About N-(2-methylcyclohexyl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide

N-(2-methylcyclohexyl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide (PubChem CID 24982672) has the molecular formula C17H26N2O4S2 and a molecular weight of 386.54 g/mol. Its IUPAC name is N-(2-methylcyclohexyl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide.

Molecular Properties

Compound NameN-(2-methylcyclohexyl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide
PubChem CID24982672
Molecular FormulaC17H26N2O4S2
Molecular Weight386.54 g/mol
Exact Mass386.13
IUPAC NameN-(2-methylcyclohexyl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide
SMILESCC1CCCCC1NC(=O)Cc1ccc(S(=O)(=O)N2CCOCC2)s1
InChIInChI=1S/C17H26N2O4S2/c1-13-4-2-3-5-15(13)18-16(20)12-14-6-7-17(24-14)25(21,22)19-8-10-23-11-9-19/h6-7,13,15H,2-5,8-12H2,1H3,(H,18,20)
InChIKeyGRUMRMUJKYBQDM-UHFFFAOYSA-N
XLogP2.01
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.54
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-methylcyclohexyl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide?
The IUPAC name of N-(2-methylcyclohexyl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide (CID 24982672) is N-(2-methylcyclohexyl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide.
What is the SMILES notation for N-(2-methylcyclohexyl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide?
The canonical SMILES for N-(2-methylcyclohexyl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide is CC1CCCCC1NC(=O)Cc1ccc(S(=O)(=O)N2CCOCC2)s1.
What is the InChIKey of N-(2-methylcyclohexyl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide?
The InChIKey is GRUMRMUJKYBQDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O4S2/c1-13-4-2-3-5-15(13)18-16(20)12-14-6-7-17(24-14)25(21,22)19-8-10-23-11-9-19/h6-7,13,15H,2-5,8-12H2,1H3,(H,18,20).
What are the key properties of N-(2-methylcyclohexyl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide?
N-(2-methylcyclohexyl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide has a molecular weight of 386.54 g/mol, XLogP of 2.01, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylcyclohexyl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide is sourced from PubChem (CID 24982672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).