2,6-dimethyl-4-(5-methyl-1,3,4-thiadiazol-2-yl)morpholine

C9H15N3OS — CID 131703787

IUPAC2,6-dimethyl-4-(5-methyl-1,3,4-thiadiazol-2-yl)morpholine
SMILESCc1nnc(N2CC(C)OC(C)C2)s1
InChIInChI=1S/C9H15N3OS/c1-6-4-12(5-7(2)13-6)9-11-10-8(3)14-9/h6-7H,4-5H2,1-3H3
InChIKeyVUOWUHPIQQEEPM-UHFFFAOYSA-N
MW213.31 g/mol
LogP1.46
Rot. Bonds1

About 2,6-dimethyl-4-(5-methyl-1,3,4-thiadiazol-2-yl)morpholine

2,6-dimethyl-4-(5-methyl-1,3,4-thiadiazol-2-yl)morpholine (PubChem CID 131703787) has the molecular formula C9H15N3OS and a molecular weight of 213.31 g/mol. Its IUPAC name is 2,6-dimethyl-4-(5-methyl-1,3,4-thiadiazol-2-yl)morpholine.

Molecular Properties

Compound Name2,6-dimethyl-4-(5-methyl-1,3,4-thiadiazol-2-yl)morpholine
PubChem CID131703787
Molecular FormulaC9H15N3OS
Molecular Weight213.31 g/mol
Exact Mass213.09
IUPAC Name2,6-dimethyl-4-(5-methyl-1,3,4-thiadiazol-2-yl)morpholine
SMILESCc1nnc(N2CC(C)OC(C)C2)s1
InChIInChI=1S/C9H15N3OS/c1-6-4-12(5-7(2)13-6)9-11-10-8(3)14-9/h6-7H,4-5H2,1-3H3
InChIKeyVUOWUHPIQQEEPM-UHFFFAOYSA-N
XLogP1.46
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.31
LogP ≤ 51.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

4-[5-(Difluoromethyl)-1,3,4-thiadiazol-2-yl]-2-(methoxymethyl)morpholine
CID 71916926
(2S)-4-[5-(difluoromethyl)-1,3,4-thiadiazol-2-yl]-2-(methoxymethyl)morpholine
CID 96542899
(2R)-4-[5-(difluoromethyl)-1,3,4-thiadiazol-2-yl]-2-(methoxymethyl)morpholine
CID 96542900
[6-Methyl-4-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]morpholin-2-yl]methanamine
CID 102938748
2-(Bromomethyl)-6-methyl-4-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]morpholine
CID 113754939
4-[5-(Trifluoromethyl)-1,3,4-thiadiazol-2-yl]morpholine-2-carbonitrile
CID 114448513
2-(Bromomethyl)-4-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]morpholine
CID 114450337
4-[5-(Difluoromethyl)-1,3,4-thiadiazol-2-yl]morpholine
CID 130162815
2-[4-(2-Propan-2-yloxyethyl)piperazin-1-yl]-5-(trifluoromethyl)-1,3,4-thiadiazole
CID 133492184
2-Ethyl-2-methyl-4-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]morpholine
CID 133506131
2,2,6,6-Tetramethyl-4-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]morpholine
CID 133507508
2-(Methoxymethyl)-6-methyl-4-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]morpholine
CID 133513020

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-4-(5-methyl-1,3,4-thiadiazol-2-yl)morpholine?
The IUPAC name of 2,6-dimethyl-4-(5-methyl-1,3,4-thiadiazol-2-yl)morpholine (CID 131703787) is 2,6-dimethyl-4-(5-methyl-1,3,4-thiadiazol-2-yl)morpholine.
What is the SMILES notation for 2,6-dimethyl-4-(5-methyl-1,3,4-thiadiazol-2-yl)morpholine?
The canonical SMILES for 2,6-dimethyl-4-(5-methyl-1,3,4-thiadiazol-2-yl)morpholine is Cc1nnc(N2CC(C)OC(C)C2)s1.
What is the InChIKey of 2,6-dimethyl-4-(5-methyl-1,3,4-thiadiazol-2-yl)morpholine?
The InChIKey is VUOWUHPIQQEEPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3OS/c1-6-4-12(5-7(2)13-6)9-11-10-8(3)14-9/h6-7H,4-5H2,1-3H3.
What are the key properties of 2,6-dimethyl-4-(5-methyl-1,3,4-thiadiazol-2-yl)morpholine?
2,6-dimethyl-4-(5-methyl-1,3,4-thiadiazol-2-yl)morpholine has a molecular weight of 213.31 g/mol, XLogP of 1.46, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-4-(5-methyl-1,3,4-thiadiazol-2-yl)morpholine is sourced from PubChem (CID 131703787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).