(1R)-1-[6-(1,3-oxazol-2-ylsulfanyl)-3-pyridinyl]ethanamine

C10H11N3OS — CID 106923159

IUPAC(1R)-1-[6-(1,3-oxazol-2-ylsulfanyl)-3-pyridinyl]ethanamine
SMILESC[C@@H](N)c1ccc(Sc2ncco2)nc1
InChIInChI=1S/C10H11N3OS/c1-7(11)8-2-3-9(13-6-8)15-10-12-4-5-14-10/h2-7H,11H2,1H3/t7-/m1/s1
InChIKeyOREYWHOBOHIGAE-SSDOTTSWSA-N
MW221.29 g/mol
LogP2.24
Rot. Bonds3

About (1R)-1-[6-(1,3-oxazol-2-ylsulfanyl)-3-pyridinyl]ethanamine

(1R)-1-[6-(1,3-oxazol-2-ylsulfanyl)-3-pyridinyl]ethanamine (PubChem CID 106923159) has the molecular formula C10H11N3OS and a molecular weight of 221.29 g/mol. Its IUPAC name is (1R)-1-[6-(1,3-oxazol-2-ylsulfanyl)-3-pyridinyl]ethanamine.

Molecular Properties

Compound Name(1R)-1-[6-(1,3-oxazol-2-ylsulfanyl)-3-pyridinyl]ethanamine
PubChem CID106923159
Molecular FormulaC10H11N3OS
Molecular Weight221.29 g/mol
Exact Mass221.06
IUPAC Name(1R)-1-[6-(1,3-oxazol-2-ylsulfanyl)-3-pyridinyl]ethanamine
SMILESC[C@@H](N)c1ccc(Sc2ncco2)nc1
InChIInChI=1S/C10H11N3OS/c1-7(11)8-2-3-9(13-6-8)15-10-12-4-5-14-10/h2-7H,11H2,1H3/t7-/m1/s1
InChIKeyOREYWHOBOHIGAE-SSDOTTSWSA-N
XLogP2.24
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.29
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-(1,3-oxazol-2-ylsulfanyl)pyrazin-2-amine
CID 106928163
(1S)-1-[5-fluoro-2-(1,3-oxazol-2-ylsulfanyl)phenyl]ethanamine
CID 106923107
4-(1,3-oxazol-2-ylsulfanyl)butan-2-amine
CID 106927407
6-(1,3-oxazol-2-ylsulfanyl)-2-propan-2-ylpyrimidin-4-amine
CID 106928339
(1S)-1-(6-pentylsulfanyl-3-pyridinyl)ethanamine
CID 107750614
(1R)-1-[3-bromo-4-(1,3-oxazol-2-ylsulfanyl)phenyl]ethanol
CID 106926854
2-(6-bromo-2-propan-2-ylpyrimidin-4-yl)sulfanyl-1,3-oxazole
CID 106923363
2-(2-methylpropylsulfanyl)-1,3-oxazole
CID 59202102
1-[3-chloro-4-(1,3-oxazol-2-ylsulfanyl)phenyl]-N-methylethanamine
CID 106923151
1-[2-(1,3-oxazol-2-ylsulfanyl)phenyl]propan-1-amine
CID 106923086
(1S)-1-(1,3-oxazol-2-yl)ethanamine
CID 28924825
2-(1,3-oxazol-2-ylsulfanyl)pyrimidin-4-amine
CID 106928161

Frequently Asked Questions

What is the IUPAC name of (1R)-1-[6-(1,3-oxazol-2-ylsulfanyl)-3-pyridinyl]ethanamine?
The IUPAC name of (1R)-1-[6-(1,3-oxazol-2-ylsulfanyl)-3-pyridinyl]ethanamine (CID 106923159) is (1R)-1-[6-(1,3-oxazol-2-ylsulfanyl)-3-pyridinyl]ethanamine.
What is the SMILES notation for (1R)-1-[6-(1,3-oxazol-2-ylsulfanyl)-3-pyridinyl]ethanamine?
The canonical SMILES for (1R)-1-[6-(1,3-oxazol-2-ylsulfanyl)-3-pyridinyl]ethanamine is C[C@@H](N)c1ccc(Sc2ncco2)nc1.
What is the InChIKey of (1R)-1-[6-(1,3-oxazol-2-ylsulfanyl)-3-pyridinyl]ethanamine?
The InChIKey is OREYWHOBOHIGAE-SSDOTTSWSA-N. The full InChI is InChI=1S/C10H11N3OS/c1-7(11)8-2-3-9(13-6-8)15-10-12-4-5-14-10/h2-7H,11H2,1H3/t7-/m1/s1.
What are the key properties of (1R)-1-[6-(1,3-oxazol-2-ylsulfanyl)-3-pyridinyl]ethanamine?
(1R)-1-[6-(1,3-oxazol-2-ylsulfanyl)-3-pyridinyl]ethanamine has a molecular weight of 221.29 g/mol, XLogP of 2.24, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[6-(1,3-oxazol-2-ylsulfanyl)-3-pyridinyl]ethanamine is sourced from PubChem (CID 106923159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).