N-morpholin-4-yl-2-piperidin-4-ylsulfanylacetamide

C11H21N3O2S — CID 114627964

IUPACN-morpholin-4-yl-2-piperidin-4-ylsulfanylacetamide
SMILESO=C(CSC1CCNCC1)NN1CCOCC1
InChIInChI=1S/C11H21N3O2S/c15-11(13-14-5-7-16-8-6-14)9-17-10-1-3-12-4-2-10/h10,12H,1-9H2,(H,13,15)
InChIKeyOVKVSYIGCZHSFM-UHFFFAOYSA-N
MW259.37 g/mol
LogP-0.17
Rot. Bonds4

About N-morpholin-4-yl-2-piperidin-4-ylsulfanylacetamide

N-morpholin-4-yl-2-piperidin-4-ylsulfanylacetamide (PubChem CID 114627964) has the molecular formula C11H21N3O2S and a molecular weight of 259.37 g/mol. Its IUPAC name is N-morpholin-4-yl-2-piperidin-4-ylsulfanylacetamide.

Molecular Properties

Compound NameN-morpholin-4-yl-2-piperidin-4-ylsulfanylacetamide
PubChem CID114627964
Molecular FormulaC11H21N3O2S
Molecular Weight259.37 g/mol
Exact Mass259.14
IUPAC NameN-morpholin-4-yl-2-piperidin-4-ylsulfanylacetamide
SMILESO=C(CSC1CCNCC1)NN1CCOCC1
InChIInChI=1S/C11H21N3O2S/c15-11(13-14-5-7-16-8-6-14)9-17-10-1-3-12-4-2-10/h10,12H,1-9H2,(H,13,15)
InChIKeyOVKVSYIGCZHSFM-UHFFFAOYSA-N
XLogP-0.17
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.37
LogP ≤ 5-0.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-morpholin-4-yl-2-piperidin-4-ylsulfanylacetamide?
The IUPAC name of N-morpholin-4-yl-2-piperidin-4-ylsulfanylacetamide (CID 114627964) is N-morpholin-4-yl-2-piperidin-4-ylsulfanylacetamide.
What is the SMILES notation for N-morpholin-4-yl-2-piperidin-4-ylsulfanylacetamide?
The canonical SMILES for N-morpholin-4-yl-2-piperidin-4-ylsulfanylacetamide is O=C(CSC1CCNCC1)NN1CCOCC1.
What is the InChIKey of N-morpholin-4-yl-2-piperidin-4-ylsulfanylacetamide?
The InChIKey is OVKVSYIGCZHSFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O2S/c15-11(13-14-5-7-16-8-6-14)9-17-10-1-3-12-4-2-10/h10,12H,1-9H2,(H,13,15).
What are the key properties of N-morpholin-4-yl-2-piperidin-4-ylsulfanylacetamide?
N-morpholin-4-yl-2-piperidin-4-ylsulfanylacetamide has a molecular weight of 259.37 g/mol, XLogP of -0.17, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-morpholin-4-yl-2-piperidin-4-ylsulfanylacetamide is sourced from PubChem (CID 114627964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).