N-(2-morpholin-4-yl-2-thiophen-3-ylethyl)methanesulfonamide

C11H18N2O3S2 — CID 16933115

IUPACN-(2-morpholin-4-yl-2-thiophen-3-ylethyl)methanesulfonamide
SMILESCS(=O)(=O)NCC(c1ccsc1)N1CCOCC1
InChIInChI=1S/C11H18N2O3S2/c1-18(14,15)12-8-11(10-2-7-17-9-10)13-3-5-16-6-4-13/h2,7,9,11-12H,3-6,8H2,1H3
InChIKeyAQQZHIKFEOMOAX-UHFFFAOYSA-N
MW290.41 g/mol
LogP0.67
Rot. Bonds5

About N-(2-morpholin-4-yl-2-thiophen-3-ylethyl)methanesulfonamide

N-(2-morpholin-4-yl-2-thiophen-3-ylethyl)methanesulfonamide (PubChem CID 16933115) has the molecular formula C11H18N2O3S2 and a molecular weight of 290.41 g/mol. Its IUPAC name is N-(2-morpholin-4-yl-2-thiophen-3-ylethyl)methanesulfonamide.

Molecular Properties

Compound NameN-(2-morpholin-4-yl-2-thiophen-3-ylethyl)methanesulfonamide
PubChem CID16933115
Molecular FormulaC11H18N2O3S2
Molecular Weight290.41 g/mol
Exact Mass290.08
IUPAC NameN-(2-morpholin-4-yl-2-thiophen-3-ylethyl)methanesulfonamide
SMILESCS(=O)(=O)NCC(c1ccsc1)N1CCOCC1
InChIInChI=1S/C11H18N2O3S2/c1-18(14,15)12-8-11(10-2-7-17-9-10)13-3-5-16-6-4-13/h2,7,9,11-12H,3-6,8H2,1H3
InChIKeyAQQZHIKFEOMOAX-UHFFFAOYSA-N
XLogP0.67
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 50.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-morpholin-4-yl-2-thiophen-3-ylethyl)methanesulfonamide?
The IUPAC name of N-(2-morpholin-4-yl-2-thiophen-3-ylethyl)methanesulfonamide (CID 16933115) is N-(2-morpholin-4-yl-2-thiophen-3-ylethyl)methanesulfonamide.
What is the SMILES notation for N-(2-morpholin-4-yl-2-thiophen-3-ylethyl)methanesulfonamide?
The canonical SMILES for N-(2-morpholin-4-yl-2-thiophen-3-ylethyl)methanesulfonamide is CS(=O)(=O)NCC(c1ccsc1)N1CCOCC1.
What is the InChIKey of N-(2-morpholin-4-yl-2-thiophen-3-ylethyl)methanesulfonamide?
The InChIKey is AQQZHIKFEOMOAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O3S2/c1-18(14,15)12-8-11(10-2-7-17-9-10)13-3-5-16-6-4-13/h2,7,9,11-12H,3-6,8H2,1H3.
What are the key properties of N-(2-morpholin-4-yl-2-thiophen-3-ylethyl)methanesulfonamide?
N-(2-morpholin-4-yl-2-thiophen-3-ylethyl)methanesulfonamide has a molecular weight of 290.41 g/mol, XLogP of 0.67, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-morpholin-4-yl-2-thiophen-3-ylethyl)methanesulfonamide is sourced from PubChem (CID 16933115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).