1-(1,2-thiazol-4-yloxy)ethanamine

C5H8N2OS — CID 117230048

IUPAC1-(1,2-thiazol-4-yloxy)ethanamine
SMILESCC(N)Oc1cnsc1
InChIInChI=1S/C5H8N2OS/c1-4(6)8-5-2-7-9-3-5/h2-4H,6H2,1H3
InChIKeyWPJHRTAYTKCXOP-UHFFFAOYSA-N
MW144.20 g/mol
LogP0.83
Rot. Bonds2

About 1-(1,2-thiazol-4-yloxy)ethanamine

1-(1,2-thiazol-4-yloxy)ethanamine (PubChem CID 117230048) has the molecular formula C5H8N2OS and a molecular weight of 144.20 g/mol. Its IUPAC name is 1-(1,2-thiazol-4-yloxy)ethanamine.

Molecular Properties

Compound Name1-(1,2-thiazol-4-yloxy)ethanamine
PubChem CID117230048
Molecular FormulaC5H8N2OS
Molecular Weight144.20 g/mol
Exact Mass144.04
IUPAC Name1-(1,2-thiazol-4-yloxy)ethanamine
SMILESCC(N)Oc1cnsc1
InChIInChI=1S/C5H8N2OS/c1-4(6)8-5-2-7-9-3-5/h2-4H,6H2,1H3
InChIKeyWPJHRTAYTKCXOP-UHFFFAOYSA-N
XLogP0.83
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.20
LogP ≤ 50.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

1,2-thiazol-4-yloxymethanamine
CID 117230046
1-(1H-pyrazol-4-yloxy)ethanamine
CID 117230019
ethane;4-propan-2-yl-1,2-thiazole
CID 142062830
1-(4-fluorophenoxy)ethanamine
CID 68874100
1-[3-(1-aminoethoxy)phenoxy]ethanamine;dihydrochloride
CID 23622432
1-[2-(4-methylphenyl)pyrimidin-5-yl]oxyethanamine
CID 117231082
4-(3-methylphenoxy)-1,2-thiazole
CID 117233619
4-[4-(1-aminoethoxy)phenyl]phenol
CID 163497782
1-[1-(4-methylphenyl)pyrazol-4-yl]oxyethanamine
CID 117230498
1-(5-propan-2-yloxy-2-pyridinyl)ethanamine
CID 67997141
1-(1-oxidopyridin-1-ium-3-yl)oxyethanamine
CID 174527116
1-[4-(2-methyl-1,3-oxazol-4-yl)phenoxy]ethanamine
CID 173233608

Frequently Asked Questions

What is the IUPAC name of 1-(1,2-thiazol-4-yloxy)ethanamine?
The IUPAC name of 1-(1,2-thiazol-4-yloxy)ethanamine (CID 117230048) is 1-(1,2-thiazol-4-yloxy)ethanamine.
What is the SMILES notation for 1-(1,2-thiazol-4-yloxy)ethanamine?
The canonical SMILES for 1-(1,2-thiazol-4-yloxy)ethanamine is CC(N)Oc1cnsc1.
What is the InChIKey of 1-(1,2-thiazol-4-yloxy)ethanamine?
The InChIKey is WPJHRTAYTKCXOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N2OS/c1-4(6)8-5-2-7-9-3-5/h2-4H,6H2,1H3.
What are the key properties of 1-(1,2-thiazol-4-yloxy)ethanamine?
1-(1,2-thiazol-4-yloxy)ethanamine has a molecular weight of 144.20 g/mol, XLogP of 0.83, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,2-thiazol-4-yloxy)ethanamine is sourced from PubChem (CID 117230048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).