N-(2-methyl-3-methylsulfanylpropyl)-2-morpholin-2-ylacetamide

C11H22N2O2S — CID 66428333

IUPACN-(2-methyl-3-methylsulfanylpropyl)-2-morpholin-2-ylacetamide
SMILESCSCC(C)CNC(=O)CC1CNCCO1
InChIInChI=1S/C11H22N2O2S/c1-9(8-16-2)6-13-11(14)5-10-7-12-3-4-15-10/h9-10,12H,3-8H2,1-2H3,(H,13,14)
InChIKeyUVNIQUWWNGNPFN-UHFFFAOYSA-N
MW246.38 g/mol
LogP0.48
Rot. Bonds6

About N-(2-methyl-3-methylsulfanylpropyl)-2-morpholin-2-ylacetamide

N-(2-methyl-3-methylsulfanylpropyl)-2-morpholin-2-ylacetamide (PubChem CID 66428333) has the molecular formula C11H22N2O2S and a molecular weight of 246.38 g/mol. Its IUPAC name is N-(2-methyl-3-methylsulfanylpropyl)-2-morpholin-2-ylacetamide.

Molecular Properties

Compound NameN-(2-methyl-3-methylsulfanylpropyl)-2-morpholin-2-ylacetamide
PubChem CID66428333
Molecular FormulaC11H22N2O2S
Molecular Weight246.38 g/mol
Exact Mass246.14
IUPAC NameN-(2-methyl-3-methylsulfanylpropyl)-2-morpholin-2-ylacetamide
SMILESCSCC(C)CNC(=O)CC1CNCCO1
InChIInChI=1S/C11H22N2O2S/c1-9(8-16-2)6-13-11(14)5-10-7-12-3-4-15-10/h9-10,12H,3-8H2,1-2H3,(H,13,14)
InChIKeyUVNIQUWWNGNPFN-UHFFFAOYSA-N
XLogP0.48
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.38
LogP ≤ 50.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-3-methylsulfanylpropyl)-2-morpholin-2-ylacetamide?
The IUPAC name of N-(2-methyl-3-methylsulfanylpropyl)-2-morpholin-2-ylacetamide (CID 66428333) is N-(2-methyl-3-methylsulfanylpropyl)-2-morpholin-2-ylacetamide.
What is the SMILES notation for N-(2-methyl-3-methylsulfanylpropyl)-2-morpholin-2-ylacetamide?
The canonical SMILES for N-(2-methyl-3-methylsulfanylpropyl)-2-morpholin-2-ylacetamide is CSCC(C)CNC(=O)CC1CNCCO1.
What is the InChIKey of N-(2-methyl-3-methylsulfanylpropyl)-2-morpholin-2-ylacetamide?
The InChIKey is UVNIQUWWNGNPFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2S/c1-9(8-16-2)6-13-11(14)5-10-7-12-3-4-15-10/h9-10,12H,3-8H2,1-2H3,(H,13,14).
What are the key properties of N-(2-methyl-3-methylsulfanylpropyl)-2-morpholin-2-ylacetamide?
N-(2-methyl-3-methylsulfanylpropyl)-2-morpholin-2-ylacetamide has a molecular weight of 246.38 g/mol, XLogP of 0.48, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-3-methylsulfanylpropyl)-2-morpholin-2-ylacetamide is sourced from PubChem (CID 66428333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).