N-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)methanesulfonamide

C12H20N2O3S2 — CID 6710462

IUPACN-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)methanesulfonamide
SMILESCC(NS(C)(=O)=O)C(c1cccs1)N1CCOCC1
InChIInChI=1S/C12H20N2O3S2/c1-10(13-19(2,15)16)12(11-4-3-9-18-11)14-5-7-17-8-6-14/h3-4,9-10,12-13H,5-8H2,1-2H3
InChIKeyCCERMTRUYGEXEB-UHFFFAOYSA-N
MW304.44 g/mol
LogP1.06
Rot. Bonds5

About N-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)methanesulfonamide

N-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)methanesulfonamide (PubChem CID 6710462) has the molecular formula C12H20N2O3S2 and a molecular weight of 304.44 g/mol. Its IUPAC name is N-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)methanesulfonamide.

Molecular Properties

Compound NameN-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)methanesulfonamide
PubChem CID6710462
Molecular FormulaC12H20N2O3S2
Molecular Weight304.44 g/mol
Exact Mass304.09
IUPAC NameN-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)methanesulfonamide
SMILESCC(NS(C)(=O)=O)C(c1cccs1)N1CCOCC1
InChIInChI=1S/C12H20N2O3S2/c1-10(13-19(2,15)16)12(11-4-3-9-18-11)14-5-7-17-8-6-14/h3-4,9-10,12-13H,5-8H2,1-2H3
InChIKeyCCERMTRUYGEXEB-UHFFFAOYSA-N
XLogP1.06
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.44
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)methanesulfonamide?
The IUPAC name of N-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)methanesulfonamide (CID 6710462) is N-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)methanesulfonamide.
What is the SMILES notation for N-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)methanesulfonamide?
The canonical SMILES for N-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)methanesulfonamide is CC(NS(C)(=O)=O)C(c1cccs1)N1CCOCC1.
What is the InChIKey of N-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)methanesulfonamide?
The InChIKey is CCERMTRUYGEXEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O3S2/c1-10(13-19(2,15)16)12(11-4-3-9-18-11)14-5-7-17-8-6-14/h3-4,9-10,12-13H,5-8H2,1-2H3.
What are the key properties of N-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)methanesulfonamide?
N-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)methanesulfonamide has a molecular weight of 304.44 g/mol, XLogP of 1.06, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-morpholin-4-yl-1-thiophen-2-ylpropan-2-yl)methanesulfonamide is sourced from PubChem (CID 6710462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).