2,6-dimethyl-4-[(2-methyl-1,3-thiazol-4-yl)methyl]morpholine

C11H18N2OS — CID 90328963

IUPAC2,6-dimethyl-4-[(2-methyl-1,3-thiazol-4-yl)methyl]morpholine
SMILESCc1nc(CN2CC(C)OC(C)C2)cs1
InChIInChI=1S/C11H18N2OS/c1-8-4-13(5-9(2)14-8)6-11-7-15-10(3)12-11/h7-9H,4-6H2,1-3H3
InChIKeyLSULABQFGVATOP-UHFFFAOYSA-N
MW226.34 g/mol
LogP2.06
Rot. Bonds2

About 2,6-dimethyl-4-[(2-methyl-1,3-thiazol-4-yl)methyl]morpholine

2,6-dimethyl-4-[(2-methyl-1,3-thiazol-4-yl)methyl]morpholine (PubChem CID 90328963) has the molecular formula C11H18N2OS and a molecular weight of 226.34 g/mol. Its IUPAC name is 2,6-dimethyl-4-[(2-methyl-1,3-thiazol-4-yl)methyl]morpholine.

Molecular Properties

Compound Name2,6-dimethyl-4-[(2-methyl-1,3-thiazol-4-yl)methyl]morpholine
PubChem CID90328963
Molecular FormulaC11H18N2OS
Molecular Weight226.34 g/mol
Exact Mass226.11
IUPAC Name2,6-dimethyl-4-[(2-methyl-1,3-thiazol-4-yl)methyl]morpholine
SMILESCc1nc(CN2CC(C)OC(C)C2)cs1
InChIInChI=1S/C11H18N2OS/c1-8-4-13(5-9(2)14-8)6-11-7-15-10(3)12-11/h7-9H,4-6H2,1-3H3
InChIKeyLSULABQFGVATOP-UHFFFAOYSA-N
XLogP2.06
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.34
LogP ≤ 52.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-4-[(2-methyl-1,3-thiazol-4-yl)methyl]morpholine?
The IUPAC name of 2,6-dimethyl-4-[(2-methyl-1,3-thiazol-4-yl)methyl]morpholine (CID 90328963) is 2,6-dimethyl-4-[(2-methyl-1,3-thiazol-4-yl)methyl]morpholine.
What is the SMILES notation for 2,6-dimethyl-4-[(2-methyl-1,3-thiazol-4-yl)methyl]morpholine?
The canonical SMILES for 2,6-dimethyl-4-[(2-methyl-1,3-thiazol-4-yl)methyl]morpholine is Cc1nc(CN2CC(C)OC(C)C2)cs1.
What is the InChIKey of 2,6-dimethyl-4-[(2-methyl-1,3-thiazol-4-yl)methyl]morpholine?
The InChIKey is LSULABQFGVATOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2OS/c1-8-4-13(5-9(2)14-8)6-11-7-15-10(3)12-11/h7-9H,4-6H2,1-3H3.
What are the key properties of 2,6-dimethyl-4-[(2-methyl-1,3-thiazol-4-yl)methyl]morpholine?
2,6-dimethyl-4-[(2-methyl-1,3-thiazol-4-yl)methyl]morpholine has a molecular weight of 226.34 g/mol, XLogP of 2.06, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-4-[(2-methyl-1,3-thiazol-4-yl)methyl]morpholine is sourced from PubChem (CID 90328963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).