4-[2-(1,3-thiazol-2-yl)ethyl]morpholine

C9H14N2OS — CID 118286140

IUPAC4-[2-(1,3-thiazol-2-yl)ethyl]morpholine
SMILESc1csc(CCN2CCOCC2)n1
InChIInChI=1S/C9H14N2OS/c1(9-10-2-8-13-9)3-11-4-6-12-7-5-11/h2,8H,1,3-7H2
InChIKeyWAJYSAZRVRVLBA-UHFFFAOYSA-N
MW198.29 g/mol
LogP1.02
Rot. Bonds3

About 4-[2-(1,3-thiazol-2-yl)ethyl]morpholine

4-[2-(1,3-thiazol-2-yl)ethyl]morpholine (PubChem CID 118286140) has the molecular formula C9H14N2OS and a molecular weight of 198.29 g/mol. Its IUPAC name is 4-[2-(1,3-thiazol-2-yl)ethyl]morpholine.

Molecular Properties

Compound Name4-[2-(1,3-thiazol-2-yl)ethyl]morpholine
PubChem CID118286140
Molecular FormulaC9H14N2OS
Molecular Weight198.29 g/mol
Exact Mass198.08
IUPAC Name4-[2-(1,3-thiazol-2-yl)ethyl]morpholine
SMILESc1csc(CCN2CCOCC2)n1
InChIInChI=1S/C9H14N2OS/c1(9-10-2-8-13-9)3-11-4-6-12-7-5-11/h2,8H,1,3-7H2
InChIKeyWAJYSAZRVRVLBA-UHFFFAOYSA-N
XLogP1.02
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.29
LogP ≤ 51.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[2-(1,3-thiazol-2-yl)ethyl]morpholine?
The IUPAC name of 4-[2-(1,3-thiazol-2-yl)ethyl]morpholine (CID 118286140) is 4-[2-(1,3-thiazol-2-yl)ethyl]morpholine.
What is the SMILES notation for 4-[2-(1,3-thiazol-2-yl)ethyl]morpholine?
The canonical SMILES for 4-[2-(1,3-thiazol-2-yl)ethyl]morpholine is c1csc(CCN2CCOCC2)n1.
What is the InChIKey of 4-[2-(1,3-thiazol-2-yl)ethyl]morpholine?
The InChIKey is WAJYSAZRVRVLBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2OS/c1(9-10-2-8-13-9)3-11-4-6-12-7-5-11/h2,8H,1,3-7H2.
What are the key properties of 4-[2-(1,3-thiazol-2-yl)ethyl]morpholine?
4-[2-(1,3-thiazol-2-yl)ethyl]morpholine has a molecular weight of 198.29 g/mol, XLogP of 1.02, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(1,3-thiazol-2-yl)ethyl]morpholine is sourced from PubChem (CID 118286140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).