(2R,3S)-2-methyl-3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)morpholine

C11H13N3O2S — CID 120955597

IUPAC(2R,3S)-2-methyl-3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)morpholine
SMILESC[C@H]1OCCN[C@@H]1c1nc(-c2cccs2)no1
InChIInChI=1S/C11H13N3O2S/c1-7-9(12-4-5-15-7)11-13-10(14-16-11)8-3-2-6-17-8/h2-3,6-7,9,12H,4-5H2,1H3/t7-,9+/m1/s1
InChIKeyOTJCGTQYXSBCKR-APPZFPTMSA-N
MW251.31 g/mol
LogP1.85
Rot. Bonds2

About (2R,3S)-2-methyl-3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)morpholine

(2R,3S)-2-methyl-3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)morpholine (PubChem CID 120955597) has the molecular formula C11H13N3O2S and a molecular weight of 251.31 g/mol. Its IUPAC name is (2R,3S)-2-methyl-3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)morpholine.

Molecular Properties

Compound Name(2R,3S)-2-methyl-3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)morpholine
PubChem CID120955597
Molecular FormulaC11H13N3O2S
Molecular Weight251.31 g/mol
Exact Mass251.07
IUPAC Name(2R,3S)-2-methyl-3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)morpholine
SMILESC[C@H]1OCCN[C@@H]1c1nc(-c2cccs2)no1
InChIInChI=1S/C11H13N3O2S/c1-7-9(12-4-5-15-7)11-13-10(14-16-11)8-3-2-6-17-8/h2-3,6-7,9,12H,4-5H2,1H3/t7-,9+/m1/s1
InChIKeyOTJCGTQYXSBCKR-APPZFPTMSA-N
XLogP1.85
TPSA60.18 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.31
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze (2R,3S)-2-methyl-3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)morpholine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-[(2S,4S)-2-methylpiperidin-4-yl]-3-thiophen-2-yl-1,2,4-oxadiazole
CID 120835592
5-(2-methylpiperidin-4-yl)-3-thiophen-2-yl-1,2,4-oxadiazole
CID 106743244
(2R)-2-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)morpholine;hydrochloride
CID 120835614
(2R,3S)-3-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-2-methylmorpholine
CID 120955592
(2R,3S)-3-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-2-methylmorpholine
CID 120955679
3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-2-methylmorpholine
CID 122236512
5-[(2S,4R)-4-fluoropyrrolidin-2-yl]-3-thiophen-2-yl-1,2,4-oxadiazole
CID 129493220
5-[(3S)-piperidin-3-yl]-3-thiophen-2-yl-1,2,4-oxadiazole;hydrochloride
CID 52951031
(3R,5R)-5-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)pyrrolidin-3-ol
CID 104912125
(3S,4R)-3-methyl-4-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)oxolan-2-one
CID 39767460
5-[(3S)-1,2,3,4-tetrahydroisoquinolin-3-yl]-3-thiophen-2-yl-1,2,4-oxadiazole
CID 28539833
5-[[(2R)-2-methylpiperazin-1-yl]methyl]-3-thiophen-2-yl-1,2,4-oxadiazole
CID 82713468

Frequently Asked Questions

What is the IUPAC name of (2R,3S)-2-methyl-3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)morpholine?
The IUPAC name of (2R,3S)-2-methyl-3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)morpholine (CID 120955597) is (2R,3S)-2-methyl-3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)morpholine.
What is the SMILES notation for (2R,3S)-2-methyl-3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)morpholine?
The canonical SMILES for (2R,3S)-2-methyl-3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)morpholine is C[C@H]1OCCN[C@@H]1c1nc(-c2cccs2)no1.
What is the InChIKey of (2R,3S)-2-methyl-3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)morpholine?
The InChIKey is OTJCGTQYXSBCKR-APPZFPTMSA-N. The full InChI is InChI=1S/C11H13N3O2S/c1-7-9(12-4-5-15-7)11-13-10(14-16-11)8-3-2-6-17-8/h2-3,6-7,9,12H,4-5H2,1H3/t7-,9+/m1/s1.
What are the key properties of (2R,3S)-2-methyl-3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)morpholine?
(2R,3S)-2-methyl-3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)morpholine has a molecular weight of 251.31 g/mol, XLogP of 1.85, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3S)-2-methyl-3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)morpholine is sourced from PubChem (CID 120955597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).