4-(3-cyclopropyl-1,2,4-thiadiazol-5-yl)-2-methylmorpholine

C10H15N3OS — CID 71925340

IUPAC4-(3-cyclopropyl-1,2,4-thiadiazol-5-yl)-2-methylmorpholine
SMILESCC1CN(c2nc(C3CC3)ns2)CCO1
InChIInChI=1S/C10H15N3OS/c1-7-6-13(4-5-14-7)10-11-9(12-15-10)8-2-3-8/h7-8H,2-6H2,1H3
InChIKeyKPFBFDRVTWEGBK-UHFFFAOYSA-N
MW225.32 g/mol
LogP1.64
Rot. Bonds2

About 4-(3-cyclopropyl-1,2,4-thiadiazol-5-yl)-2-methylmorpholine

4-(3-cyclopropyl-1,2,4-thiadiazol-5-yl)-2-methylmorpholine (PubChem CID 71925340) has the molecular formula C10H15N3OS and a molecular weight of 225.32 g/mol. Its IUPAC name is 4-(3-cyclopropyl-1,2,4-thiadiazol-5-yl)-2-methylmorpholine.

Molecular Properties

Compound Name4-(3-cyclopropyl-1,2,4-thiadiazol-5-yl)-2-methylmorpholine
PubChem CID71925340
Molecular FormulaC10H15N3OS
Molecular Weight225.32 g/mol
Exact Mass225.09
IUPAC Name4-(3-cyclopropyl-1,2,4-thiadiazol-5-yl)-2-methylmorpholine
SMILESCC1CN(c2nc(C3CC3)ns2)CCO1
InChIInChI=1S/C10H15N3OS/c1-7-6-13(4-5-14-7)10-11-9(12-15-10)8-2-3-8/h7-8H,2-6H2,1H3
InChIKeyKPFBFDRVTWEGBK-UHFFFAOYSA-N
XLogP1.64
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.32
LogP ≤ 51.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

4-(3-Propan-2-yl-1,2,4-thiadiazol-5-yl)morpholine
CID 71866356
4-(3-Cyclopropyl-1,2,4-thiadiazol-5-yl)morpholine
CID 71925342
4-[2-[1-(3-Propan-2-yl-1,2,4-thiadiazol-5-yl)piperidin-4-yl]oxyethyl]morpholine
CID 84585899
(2R,3R)-2,3-dimethyl-4-(3-methyl-1,2,4-thiadiazol-5-yl)morpholine
CID 98793337
3-Methyl-4-(3-propan-2-yl-1,2,4-thiadiazol-5-yl)morpholine
CID 71861557
(2S)-4-(3-ethyl-1,2,4-thiadiazol-5-yl)-2-methylmorpholine
CID 96566785
(3S)-4-(3-ethyl-1,2,4-thiadiazol-5-yl)-3-methylmorpholine
CID 97059887
(3R)-3-cyclopropyl-4-(3-ethyl-1,2,4-thiadiazol-5-yl)morpholine
CID 97827283
(2S)-4-(3-ethyl-1,2,4-thiadiazol-5-yl)-2-(morpholin-4-ylmethyl)morpholine
CID 164640503
(2R,6S)-2,6-dimethyl-4-(3-methyl-1,2,4-thiadiazol-5-yl)morpholine
CID 97009069
(2S,3R)-2,3-dimethyl-4-(3-methyl-1,2,4-thiadiazol-5-yl)morpholine
CID 98793335
4-(3-Ethyl-1,2,4-thiadiazol-5-yl)-2,2-difluoromorpholine
CID 125419912

Frequently Asked Questions

What is the IUPAC name of 4-(3-cyclopropyl-1,2,4-thiadiazol-5-yl)-2-methylmorpholine?
The IUPAC name of 4-(3-cyclopropyl-1,2,4-thiadiazol-5-yl)-2-methylmorpholine (CID 71925340) is 4-(3-cyclopropyl-1,2,4-thiadiazol-5-yl)-2-methylmorpholine.
What is the SMILES notation for 4-(3-cyclopropyl-1,2,4-thiadiazol-5-yl)-2-methylmorpholine?
The canonical SMILES for 4-(3-cyclopropyl-1,2,4-thiadiazol-5-yl)-2-methylmorpholine is CC1CN(c2nc(C3CC3)ns2)CCO1.
What is the InChIKey of 4-(3-cyclopropyl-1,2,4-thiadiazol-5-yl)-2-methylmorpholine?
The InChIKey is KPFBFDRVTWEGBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3OS/c1-7-6-13(4-5-14-7)10-11-9(12-15-10)8-2-3-8/h7-8H,2-6H2,1H3.
What are the key properties of 4-(3-cyclopropyl-1,2,4-thiadiazol-5-yl)-2-methylmorpholine?
4-(3-cyclopropyl-1,2,4-thiadiazol-5-yl)-2-methylmorpholine has a molecular weight of 225.32 g/mol, XLogP of 1.64, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-cyclopropyl-1,2,4-thiadiazol-5-yl)-2-methylmorpholine is sourced from PubChem (CID 71925340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).