2-[2-(oxolan-2-yl)-1,3-thiazol-5-yl]ethanamine

C9H14N2OS — CID 115021526

IUPAC2-[2-(oxolan-2-yl)-1,3-thiazol-5-yl]ethanamine
SMILESNCCc1cnc(C2CCCO2)s1
InChIInChI=1S/C9H14N2OS/c10-4-3-7-6-11-9(13-7)8-2-1-5-12-8/h6,8H,1-5,10H2
InChIKeyREKQBANWZLUTJF-UHFFFAOYSA-N
MW198.29 g/mol
LogP1.50
Rot. Bonds3

About 2-[2-(oxolan-2-yl)-1,3-thiazol-5-yl]ethanamine

2-[2-(oxolan-2-yl)-1,3-thiazol-5-yl]ethanamine (PubChem CID 115021526) has the molecular formula C9H14N2OS and a molecular weight of 198.29 g/mol. Its IUPAC name is 2-[2-(oxolan-2-yl)-1,3-thiazol-5-yl]ethanamine.

Molecular Properties

Compound Name2-[2-(oxolan-2-yl)-1,3-thiazol-5-yl]ethanamine
PubChem CID115021526
Molecular FormulaC9H14N2OS
Molecular Weight198.29 g/mol
Exact Mass198.08
IUPAC Name2-[2-(oxolan-2-yl)-1,3-thiazol-5-yl]ethanamine
SMILESNCCc1cnc(C2CCCO2)s1
InChIInChI=1S/C9H14N2OS/c10-4-3-7-6-11-9(13-7)8-2-1-5-12-8/h6,8H,1-5,10H2
InChIKeyREKQBANWZLUTJF-UHFFFAOYSA-N
XLogP1.50
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.29
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[2-(oxan-2-yl)-1,3-thiazol-5-yl]propan-1-amine
CID 115035808
2-[2-(oxolan-2-yl)-1,3-thiazol-4-yl]ethanamine
CID 65328335
[3-methyl-1-[[2-(oxolan-2-yl)-1,3-thiazol-5-yl]methyl]pyrrolidin-3-yl]methanamine
CID 120781234
2-[(2S)-oxolan-2-yl]-1,3-thiazole-5-carbaldehyde
CID 92669690
2-[2-(1-ethylpiperidin-4-yl)-1,3-thiazol-5-yl]ethanamine
CID 115089977
N-[1-[2-(oxolan-2-yl)-1,3-thiazol-5-yl]ethyl]propan-1-amine
CID 65328204
[2-(oxolan-2-yl)-1,3-thiazol-4-yl]methanamine
CID 64982766
2-[[2-(oxolan-2-yl)-1,3-thiazole-5-carbonyl]amino]acetic acid
CID 120513587
[(1S,2R)-2-methylcyclopropyl]methyl 2-[(2S)-oxolan-2-yl]-1,3-thiazole-5-carboxylate
CID 97099428
[2-(oxolan-2-yl)pyrimidin-5-yl]methanamine
CID 65328893
4-[2-(oxolan-2-yl)-1,3-thiazol-5-yl]-N-propyl-1,3-thiazol-2-amine
CID 82423655
(1R)-1-cyclopropyl-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[[2-[(2S)-oxolan-2-yl]-1,3-thiazol-5-yl]methyl]methanamine
CID 97079179

Frequently Asked Questions

What is the IUPAC name of 2-[2-(oxolan-2-yl)-1,3-thiazol-5-yl]ethanamine?
The IUPAC name of 2-[2-(oxolan-2-yl)-1,3-thiazol-5-yl]ethanamine (CID 115021526) is 2-[2-(oxolan-2-yl)-1,3-thiazol-5-yl]ethanamine.
What is the SMILES notation for 2-[2-(oxolan-2-yl)-1,3-thiazol-5-yl]ethanamine?
The canonical SMILES for 2-[2-(oxolan-2-yl)-1,3-thiazol-5-yl]ethanamine is NCCc1cnc(C2CCCO2)s1.
What is the InChIKey of 2-[2-(oxolan-2-yl)-1,3-thiazol-5-yl]ethanamine?
The InChIKey is REKQBANWZLUTJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2OS/c10-4-3-7-6-11-9(13-7)8-2-1-5-12-8/h6,8H,1-5,10H2.
What are the key properties of 2-[2-(oxolan-2-yl)-1,3-thiazol-5-yl]ethanamine?
2-[2-(oxolan-2-yl)-1,3-thiazol-5-yl]ethanamine has a molecular weight of 198.29 g/mol, XLogP of 1.50, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(oxolan-2-yl)-1,3-thiazol-5-yl]ethanamine is sourced from PubChem (CID 115021526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).