N-(2-morpholin-4-ylethyl)-2-phenyl-2-phenylsulfanylacetamide

C20H24N2O2S — CID 3843296

IUPACN-(2-morpholin-4-ylethyl)-2-phenyl-2-phenylsulfanylacetamide
SMILESO=C(NCCN1CCOCC1)C(Sc1ccccc1)c1ccccc1
InChIInChI=1S/C20H24N2O2S/c23-20(21-11-12-22-13-15-24-16-14-22)19(17-7-3-1-4-8-17)25-18-9-5-2-6-10-18/h1-10,19H,11-16H2,(H,21,23)
InChIKeyJWQIMURDRJEHNM-UHFFFAOYSA-N
MW356.49 g/mol
LogP2.97
Rot. Bonds7

About N-(2-morpholin-4-ylethyl)-2-phenyl-2-phenylsulfanylacetamide

N-(2-morpholin-4-ylethyl)-2-phenyl-2-phenylsulfanylacetamide (PubChem CID 3843296) has the molecular formula C20H24N2O2S and a molecular weight of 356.49 g/mol. Its IUPAC name is N-(2-morpholin-4-ylethyl)-2-phenyl-2-phenylsulfanylacetamide.

Molecular Properties

Compound NameN-(2-morpholin-4-ylethyl)-2-phenyl-2-phenylsulfanylacetamide
PubChem CID3843296
Molecular FormulaC20H24N2O2S
Molecular Weight356.49 g/mol
Exact Mass356.16
IUPAC NameN-(2-morpholin-4-ylethyl)-2-phenyl-2-phenylsulfanylacetamide
SMILESO=C(NCCN1CCOCC1)C(Sc1ccccc1)c1ccccc1
InChIInChI=1S/C20H24N2O2S/c23-20(21-11-12-22-13-15-24-16-14-22)19(17-7-3-1-4-8-17)25-18-9-5-2-6-10-18/h1-10,19H,11-16H2,(H,21,23)
InChIKeyJWQIMURDRJEHNM-UHFFFAOYSA-N
XLogP2.97
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.49
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-morpholin-4-ylethyl)-2-phenyl-2-phenylsulfanylacetamide?
The IUPAC name of N-(2-morpholin-4-ylethyl)-2-phenyl-2-phenylsulfanylacetamide (CID 3843296) is N-(2-morpholin-4-ylethyl)-2-phenyl-2-phenylsulfanylacetamide.
What is the SMILES notation for N-(2-morpholin-4-ylethyl)-2-phenyl-2-phenylsulfanylacetamide?
The canonical SMILES for N-(2-morpholin-4-ylethyl)-2-phenyl-2-phenylsulfanylacetamide is O=C(NCCN1CCOCC1)C(Sc1ccccc1)c1ccccc1.
What is the InChIKey of N-(2-morpholin-4-ylethyl)-2-phenyl-2-phenylsulfanylacetamide?
The InChIKey is JWQIMURDRJEHNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O2S/c23-20(21-11-12-22-13-15-24-16-14-22)19(17-7-3-1-4-8-17)25-18-9-5-2-6-10-18/h1-10,19H,11-16H2,(H,21,23).
What are the key properties of N-(2-morpholin-4-ylethyl)-2-phenyl-2-phenylsulfanylacetamide?
N-(2-morpholin-4-ylethyl)-2-phenyl-2-phenylsulfanylacetamide has a molecular weight of 356.49 g/mol, XLogP of 2.97, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-morpholin-4-ylethyl)-2-phenyl-2-phenylsulfanylacetamide is sourced from PubChem (CID 3843296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).