4-[(4-methyl-1,3-thiazol-5-yl)methyl]morpholine

C9H14N2OS — CID 130383068

IUPAC4-[(4-methyl-1,3-thiazol-5-yl)methyl]morpholine
SMILESCc1ncsc1CN1CCOCC1
InChIInChI=1S/C9H14N2OS/c1-8-9(13-7-10-8)6-11-2-4-12-5-3-11/h7H,2-6H2,1H3
InChIKeyMTSCXTQEXLXQTN-UHFFFAOYSA-N
MW198.29 g/mol
LogP1.28
Rot. Bonds2

About 4-[(4-methyl-1,3-thiazol-5-yl)methyl]morpholine

4-[(4-methyl-1,3-thiazol-5-yl)methyl]morpholine (PubChem CID 130383068) has the molecular formula C9H14N2OS and a molecular weight of 198.29 g/mol. Its IUPAC name is 4-[(4-methyl-1,3-thiazol-5-yl)methyl]morpholine.

Molecular Properties

Compound Name4-[(4-methyl-1,3-thiazol-5-yl)methyl]morpholine
PubChem CID130383068
Molecular FormulaC9H14N2OS
Molecular Weight198.29 g/mol
Exact Mass198.08
IUPAC Name4-[(4-methyl-1,3-thiazol-5-yl)methyl]morpholine
SMILESCc1ncsc1CN1CCOCC1
InChIInChI=1S/C9H14N2OS/c1-8-9(13-7-10-8)6-11-2-4-12-5-3-11/h7H,2-6H2,1H3
InChIKeyMTSCXTQEXLXQTN-UHFFFAOYSA-N
XLogP1.28
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.29
LogP ≤ 51.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[(4-methyl-1,3-thiazol-5-yl)methyl]morpholine?
The IUPAC name of 4-[(4-methyl-1,3-thiazol-5-yl)methyl]morpholine (CID 130383068) is 4-[(4-methyl-1,3-thiazol-5-yl)methyl]morpholine.
What is the SMILES notation for 4-[(4-methyl-1,3-thiazol-5-yl)methyl]morpholine?
The canonical SMILES for 4-[(4-methyl-1,3-thiazol-5-yl)methyl]morpholine is Cc1ncsc1CN1CCOCC1.
What is the InChIKey of 4-[(4-methyl-1,3-thiazol-5-yl)methyl]morpholine?
The InChIKey is MTSCXTQEXLXQTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2OS/c1-8-9(13-7-10-8)6-11-2-4-12-5-3-11/h7H,2-6H2,1H3.
What are the key properties of 4-[(4-methyl-1,3-thiazol-5-yl)methyl]morpholine?
4-[(4-methyl-1,3-thiazol-5-yl)methyl]morpholine has a molecular weight of 198.29 g/mol, XLogP of 1.28, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-methyl-1,3-thiazol-5-yl)methyl]morpholine is sourced from PubChem (CID 130383068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).