[(2R,6R)-2,6-dimethylmorpholin-4-yl]-(4-methylthiadiazol-5-yl)methanone

C10H15N3O2S — CID 7576747

IUPAC[(2R,6R)-2,6-dimethylmorpholin-4-yl]-(4-methylthiadiazol-5-yl)methanone
SMILESCc1nnsc1C(=O)N1C[C@@H](C)O[C@H](C)C1
InChIInChI=1S/C10H15N3O2S/c1-6-4-13(5-7(2)15-6)10(14)9-8(3)11-12-16-9/h6-7H,4-5H2,1-3H3/t6-,7-/m1/s1
InChIKeyKWRFJMRSZKBQPB-RNFRBKRXSA-N
MW241.32 g/mol
LogP1.10
Rot. Bonds1

About [(2R,6R)-2,6-dimethylmorpholin-4-yl]-(4-methylthiadiazol-5-yl)methanone

[(2R,6R)-2,6-dimethylmorpholin-4-yl]-(4-methylthiadiazol-5-yl)methanone (PubChem CID 7576747) has the molecular formula C10H15N3O2S and a molecular weight of 241.32 g/mol. Its IUPAC name is [(2R,6R)-2,6-dimethylmorpholin-4-yl]-(4-methylthiadiazol-5-yl)methanone.

Molecular Properties

Compound Name[(2R,6R)-2,6-dimethylmorpholin-4-yl]-(4-methylthiadiazol-5-yl)methanone
PubChem CID7576747
Molecular FormulaC10H15N3O2S
Molecular Weight241.32 g/mol
Exact Mass241.09
IUPAC Name[(2R,6R)-2,6-dimethylmorpholin-4-yl]-(4-methylthiadiazol-5-yl)methanone
SMILESCc1nnsc1C(=O)N1C[C@@H](C)O[C@H](C)C1
InChIInChI=1S/C10H15N3O2S/c1-6-4-13(5-7(2)15-6)10(14)9-8(3)11-12-16-9/h6-7H,4-5H2,1-3H3/t6-,7-/m1/s1
InChIKeyKWRFJMRSZKBQPB-RNFRBKRXSA-N
XLogP1.10
TPSA55.32 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.32
LogP ≤ 51.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [(2R,6R)-2,6-dimethylmorpholin-4-yl]-(4-methylthiadiazol-5-yl)methanone?
The IUPAC name of [(2R,6R)-2,6-dimethylmorpholin-4-yl]-(4-methylthiadiazol-5-yl)methanone (CID 7576747) is [(2R,6R)-2,6-dimethylmorpholin-4-yl]-(4-methylthiadiazol-5-yl)methanone.
What is the SMILES notation for [(2R,6R)-2,6-dimethylmorpholin-4-yl]-(4-methylthiadiazol-5-yl)methanone?
The canonical SMILES for [(2R,6R)-2,6-dimethylmorpholin-4-yl]-(4-methylthiadiazol-5-yl)methanone is Cc1nnsc1C(=O)N1C[C@@H](C)O[C@H](C)C1.
What is the InChIKey of [(2R,6R)-2,6-dimethylmorpholin-4-yl]-(4-methylthiadiazol-5-yl)methanone?
The InChIKey is KWRFJMRSZKBQPB-RNFRBKRXSA-N. The full InChI is InChI=1S/C10H15N3O2S/c1-6-4-13(5-7(2)15-6)10(14)9-8(3)11-12-16-9/h6-7H,4-5H2,1-3H3/t6-,7-/m1/s1.
What are the key properties of [(2R,6R)-2,6-dimethylmorpholin-4-yl]-(4-methylthiadiazol-5-yl)methanone?
[(2R,6R)-2,6-dimethylmorpholin-4-yl]-(4-methylthiadiazol-5-yl)methanone has a molecular weight of 241.32 g/mol, XLogP of 1.10, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R,6R)-2,6-dimethylmorpholin-4-yl]-(4-methylthiadiazol-5-yl)methanone is sourced from PubChem (CID 7576747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).