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

C11H16N2OS — CID 172572591

IUPAC4-[1-(1,3-thiazol-2-yl)cyclobutyl]morpholine
SMILESc1csc(C2(N3CCOCC3)CCC2)n1
InChIInChI=1S/C11H16N2OS/c1-2-11(3-1,10-12-4-9-15-10)13-5-7-14-8-6-13/h4,9H,1-3,5-8H2
InChIKeyNVBJUMFJTQHBCZ-UHFFFAOYSA-N
MW224.33 g/mol
LogP1.85
Rot. Bonds2

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

4-[1-(1,3-thiazol-2-yl)cyclobutyl]morpholine (PubChem CID 172572591) has the molecular formula C11H16N2OS and a molecular weight of 224.33 g/mol. Its IUPAC name is 4-[1-(1,3-thiazol-2-yl)cyclobutyl]morpholine.

Molecular Properties

Compound Name4-[1-(1,3-thiazol-2-yl)cyclobutyl]morpholine
PubChem CID172572591
Molecular FormulaC11H16N2OS
Molecular Weight224.33 g/mol
Exact Mass224.10
IUPAC Name4-[1-(1,3-thiazol-2-yl)cyclobutyl]morpholine
SMILESc1csc(C2(N3CCOCC3)CCC2)n1
InChIInChI=1S/C11H16N2OS/c1-2-11(3-1,10-12-4-9-15-10)13-5-7-14-8-6-13/h4,9H,1-3,5-8H2
InChIKeyNVBJUMFJTQHBCZ-UHFFFAOYSA-N
XLogP1.85
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.33
LogP ≤ 51.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[1-(1,3-thiazol-2-yl)cyclobutyl]morpholine?
The IUPAC name of 4-[1-(1,3-thiazol-2-yl)cyclobutyl]morpholine (CID 172572591) is 4-[1-(1,3-thiazol-2-yl)cyclobutyl]morpholine.
What is the SMILES notation for 4-[1-(1,3-thiazol-2-yl)cyclobutyl]morpholine?
The canonical SMILES for 4-[1-(1,3-thiazol-2-yl)cyclobutyl]morpholine is c1csc(C2(N3CCOCC3)CCC2)n1.
What is the InChIKey of 4-[1-(1,3-thiazol-2-yl)cyclobutyl]morpholine?
The InChIKey is NVBJUMFJTQHBCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2OS/c1-2-11(3-1,10-12-4-9-15-10)13-5-7-14-8-6-13/h4,9H,1-3,5-8H2.
What are the key properties of 4-[1-(1,3-thiazol-2-yl)cyclobutyl]morpholine?
4-[1-(1,3-thiazol-2-yl)cyclobutyl]morpholine has a molecular weight of 224.33 g/mol, XLogP of 1.85, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(1,3-thiazol-2-yl)cyclobutyl]morpholine is sourced from PubChem (CID 172572591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).