(2S,6R)-4-[6-(2-methoxy-1,3-thiazol-4-yl)-3-pyridinyl]-2,6-dimethylmorpholine

C15H19N3O2S — CID 141223502

IUPAC(2S,6R)-4-[6-(2-methoxy-1,3-thiazol-4-yl)-3-pyridinyl]-2,6-dimethylmorpholine
SMILESCOc1nc(-c2ccc(N3C[C@@H](C)O[C@@H](C)C3)cn2)cs1
InChIInChI=1S/C15H19N3O2S/c1-10-7-18(8-11(2)20-10)12-4-5-13(16-6-12)14-9-21-15(17-14)19-3/h4-6,9-11H,7-8H2,1-3H3/t10-,11+
InChIKeyARMQASRVBQVKLD-PHIMTYICSA-N
MW305.40 g/mol
LogP2.83
Rot. Bonds3

About (2S,6R)-4-[6-(2-methoxy-1,3-thiazol-4-yl)-3-pyridinyl]-2,6-dimethylmorpholine

(2S,6R)-4-[6-(2-methoxy-1,3-thiazol-4-yl)-3-pyridinyl]-2,6-dimethylmorpholine (PubChem CID 141223502) has the molecular formula C15H19N3O2S and a molecular weight of 305.40 g/mol. Its IUPAC name is (2S,6R)-4-[6-(2-methoxy-1,3-thiazol-4-yl)-3-pyridinyl]-2,6-dimethylmorpholine.

Molecular Properties

Compound Name(2S,6R)-4-[6-(2-methoxy-1,3-thiazol-4-yl)-3-pyridinyl]-2,6-dimethylmorpholine
PubChem CID141223502
Molecular FormulaC15H19N3O2S
Molecular Weight305.40 g/mol
Exact Mass305.12
IUPAC Name(2S,6R)-4-[6-(2-methoxy-1,3-thiazol-4-yl)-3-pyridinyl]-2,6-dimethylmorpholine
SMILESCOc1nc(-c2ccc(N3C[C@@H](C)O[C@@H](C)C3)cn2)cs1
InChIInChI=1S/C15H19N3O2S/c1-10-7-18(8-11(2)20-10)12-4-5-13(16-6-12)14-9-21-15(17-14)19-3/h4-6,9-11H,7-8H2,1-3H3/t10-,11+
InChIKeyARMQASRVBQVKLD-PHIMTYICSA-N
XLogP2.83
TPSA47.48 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.40
LogP ≤ 52.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of (2S,6R)-4-[6-(2-methoxy-1,3-thiazol-4-yl)-3-pyridinyl]-2,6-dimethylmorpholine?
The IUPAC name of (2S,6R)-4-[6-(2-methoxy-1,3-thiazol-4-yl)-3-pyridinyl]-2,6-dimethylmorpholine (CID 141223502) is (2S,6R)-4-[6-(2-methoxy-1,3-thiazol-4-yl)-3-pyridinyl]-2,6-dimethylmorpholine.
What is the SMILES notation for (2S,6R)-4-[6-(2-methoxy-1,3-thiazol-4-yl)-3-pyridinyl]-2,6-dimethylmorpholine?
The canonical SMILES for (2S,6R)-4-[6-(2-methoxy-1,3-thiazol-4-yl)-3-pyridinyl]-2,6-dimethylmorpholine is COc1nc(-c2ccc(N3C[C@@H](C)O[C@@H](C)C3)cn2)cs1.
What is the InChIKey of (2S,6R)-4-[6-(2-methoxy-1,3-thiazol-4-yl)-3-pyridinyl]-2,6-dimethylmorpholine?
The InChIKey is ARMQASRVBQVKLD-PHIMTYICSA-N. The full InChI is InChI=1S/C15H19N3O2S/c1-10-7-18(8-11(2)20-10)12-4-5-13(16-6-12)14-9-21-15(17-14)19-3/h4-6,9-11H,7-8H2,1-3H3/t10-,11+.
What are the key properties of (2S,6R)-4-[6-(2-methoxy-1,3-thiazol-4-yl)-3-pyridinyl]-2,6-dimethylmorpholine?
(2S,6R)-4-[6-(2-methoxy-1,3-thiazol-4-yl)-3-pyridinyl]-2,6-dimethylmorpholine has a molecular weight of 305.40 g/mol, XLogP of 2.83, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,6R)-4-[6-(2-methoxy-1,3-thiazol-4-yl)-3-pyridinyl]-2,6-dimethylmorpholine is sourced from PubChem (CID 141223502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).