[(2R,6R)-2-methyl-6-thiophen-3-ylmorpholin-4-yl]-[(2R)-pyrrolidin-2-yl]methanone

C14H20N2O2S — CID 124694505

IUPAC[(2R,6R)-2-methyl-6-thiophen-3-ylmorpholin-4-yl]-[(2R)-pyrrolidin-2-yl]methanone
SMILESC[C@@H]1CN(C(=O)[C@H]2CCCN2)C[C@@H](c2ccsc2)O1
InChIInChI=1S/C14H20N2O2S/c1-10-7-16(14(17)12-3-2-5-15-12)8-13(18-10)11-4-6-19-9-11/h4,6,9-10,12-13,15H,2-3,5,7-8H2,1H3/t10-,12-,13+/m1/s1
InChIKeyGSNUYALSQAVKHS-RTXFEEFZSA-N
MW280.39 g/mol
LogP1.79
Rot. Bonds2

About [(2R,6R)-2-methyl-6-thiophen-3-ylmorpholin-4-yl]-[(2R)-pyrrolidin-2-yl]methanone

[(2R,6R)-2-methyl-6-thiophen-3-ylmorpholin-4-yl]-[(2R)-pyrrolidin-2-yl]methanone (PubChem CID 124694505) has the molecular formula C14H20N2O2S and a molecular weight of 280.39 g/mol. Its IUPAC name is [(2R,6R)-2-methyl-6-thiophen-3-ylmorpholin-4-yl]-[(2R)-pyrrolidin-2-yl]methanone.

Molecular Properties

Compound Name[(2R,6R)-2-methyl-6-thiophen-3-ylmorpholin-4-yl]-[(2R)-pyrrolidin-2-yl]methanone
PubChem CID124694505
Molecular FormulaC14H20N2O2S
Molecular Weight280.39 g/mol
Exact Mass280.12
IUPAC Name[(2R,6R)-2-methyl-6-thiophen-3-ylmorpholin-4-yl]-[(2R)-pyrrolidin-2-yl]methanone
SMILESC[C@@H]1CN(C(=O)[C@H]2CCCN2)C[C@@H](c2ccsc2)O1
InChIInChI=1S/C14H20N2O2S/c1-10-7-16(14(17)12-3-2-5-15-12)8-13(18-10)11-4-6-19-9-11/h4,6,9-10,12-13,15H,2-3,5,7-8H2,1H3/t10-,12-,13+/m1/s1
InChIKeyGSNUYALSQAVKHS-RTXFEEFZSA-N
XLogP1.79
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.39
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [(2R,6R)-2-methyl-6-thiophen-3-ylmorpholin-4-yl]-[(2R)-pyrrolidin-2-yl]methanone with MolForge

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Related Compounds

(2-methyl-6-phenylmorpholin-4-yl)-piperidin-2-ylmethanone;hydrochloride
CID 119304765
1-(2-methyl-6-thiophen-3-ylmorpholin-4-yl)ethanone
CID 167980764
piperidin-2-yl-(2-thiophen-3-ylmorpholin-4-yl)methanone;hydrochloride
CID 119339142
[(2R,6S)-2-methyl-6-thiophen-3-ylmorpholin-4-yl]-[(2S)-morpholin-2-yl]methanone
CID 125135325
(3-aminocyclopentyl)-(2-methyl-6-thiophen-3-ylmorpholin-4-yl)methanone
CID 119810914
(9-amino-3-bicyclo[3.3.1]nonanyl)-(2-methyl-6-thiophen-3-ylmorpholin-4-yl)methanone;hydrochloride
CID 120992573
2-(methylamino)-1-[(2R,6R)-2-methyl-6-thiophen-3-ylmorpholin-4-yl]ethanone
CID 124686454
2-(1,3-dioxan-2-yl)-1-[(2S,6R)-2-methyl-6-thiophen-3-ylmorpholin-4-yl]ethanone
CID 125140010
1H-indol-7-yl-[(2S,6R)-2-methyl-6-thiophen-3-ylmorpholin-4-yl]methanone
CID 124592372
(2R,6R)-2-methyl-N-(5-methyl-1,3,4-thiadiazol-2-yl)-6-thiophen-3-ylmorpholine-4-carboxamide
CID 97074965
[(3R,4S)-4-(1-methylpyrazol-4-yl)pyrrolidin-3-yl]-(2-methyl-6-thiophen-3-ylmorpholin-4-yl)methanone;hydrochloride
CID 120936041
(2S,6S)-N-(2-cyclopropylpyrimidin-5-yl)-2-methyl-6-thiophen-3-ylmorpholine-4-carboxamide
CID 97225798

Frequently Asked Questions

What is the IUPAC name of [(2R,6R)-2-methyl-6-thiophen-3-ylmorpholin-4-yl]-[(2R)-pyrrolidin-2-yl]methanone?
The IUPAC name of [(2R,6R)-2-methyl-6-thiophen-3-ylmorpholin-4-yl]-[(2R)-pyrrolidin-2-yl]methanone (CID 124694505) is [(2R,6R)-2-methyl-6-thiophen-3-ylmorpholin-4-yl]-[(2R)-pyrrolidin-2-yl]methanone.
What is the SMILES notation for [(2R,6R)-2-methyl-6-thiophen-3-ylmorpholin-4-yl]-[(2R)-pyrrolidin-2-yl]methanone?
The canonical SMILES for [(2R,6R)-2-methyl-6-thiophen-3-ylmorpholin-4-yl]-[(2R)-pyrrolidin-2-yl]methanone is C[C@@H]1CN(C(=O)[C@H]2CCCN2)C[C@@H](c2ccsc2)O1.
What is the InChIKey of [(2R,6R)-2-methyl-6-thiophen-3-ylmorpholin-4-yl]-[(2R)-pyrrolidin-2-yl]methanone?
The InChIKey is GSNUYALSQAVKHS-RTXFEEFZSA-N. The full InChI is InChI=1S/C14H20N2O2S/c1-10-7-16(14(17)12-3-2-5-15-12)8-13(18-10)11-4-6-19-9-11/h4,6,9-10,12-13,15H,2-3,5,7-8H2,1H3/t10-,12-,13+/m1/s1.
What are the key properties of [(2R,6R)-2-methyl-6-thiophen-3-ylmorpholin-4-yl]-[(2R)-pyrrolidin-2-yl]methanone?
[(2R,6R)-2-methyl-6-thiophen-3-ylmorpholin-4-yl]-[(2R)-pyrrolidin-2-yl]methanone has a molecular weight of 280.39 g/mol, XLogP of 1.79, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R,6R)-2-methyl-6-thiophen-3-ylmorpholin-4-yl]-[(2R)-pyrrolidin-2-yl]methanone is sourced from PubChem (CID 124694505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).