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

C10H11N3O2S — CID 100657080

IUPAC(3S)-3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)morpholine
SMILESc1csc(-c2nnc([C@@H]3COCCN3)o2)c1
InChIInChI=1S/C10H11N3O2S/c1-2-8(16-5-1)10-13-12-9(15-10)7-6-14-4-3-11-7/h1-2,5,7,11H,3-4,6H2/t7-/m0/s1
InChIKeyVIZQWPFWAHBIKH-ZETCQYMHSA-N
MW237.28 g/mol
LogP1.46
Rot. Bonds2

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

(3S)-3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)morpholine (PubChem CID 100657080) has the molecular formula C10H11N3O2S and a molecular weight of 237.28 g/mol. Its IUPAC name is (3S)-3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)morpholine.

Molecular Properties

Compound Name(3S)-3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)morpholine
PubChem CID100657080
Molecular FormulaC10H11N3O2S
Molecular Weight237.28 g/mol
Exact Mass237.06
IUPAC Name(3S)-3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)morpholine
SMILESc1csc(-c2nnc([C@@H]3COCCN3)o2)c1
InChIInChI=1S/C10H11N3O2S/c1-2-8(16-5-1)10-13-12-9(15-10)7-6-14-4-3-11-7/h1-2,5,7,11H,3-4,6H2/t7-/m0/s1
InChIKeyVIZQWPFWAHBIKH-ZETCQYMHSA-N
XLogP1.46
TPSA60.18 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.28
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of (3S)-3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)morpholine?
The IUPAC name of (3S)-3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)morpholine (CID 100657080) is (3S)-3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)morpholine.
What is the SMILES notation for (3S)-3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)morpholine?
The canonical SMILES for (3S)-3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)morpholine is c1csc(-c2nnc([C@@H]3COCCN3)o2)c1.
What is the InChIKey of (3S)-3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)morpholine?
The InChIKey is VIZQWPFWAHBIKH-ZETCQYMHSA-N. The full InChI is InChI=1S/C10H11N3O2S/c1-2-8(16-5-1)10-13-12-9(15-10)7-6-14-4-3-11-7/h1-2,5,7,11H,3-4,6H2/t7-/m0/s1.
What are the key properties of (3S)-3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)morpholine?
(3S)-3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)morpholine has a molecular weight of 237.28 g/mol, XLogP of 1.46, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-3-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)morpholine is sourced from PubChem (CID 100657080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).