1-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)ethanol

C10H11NO2S — CID 69240115

IUPAC1-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)ethanol
SMILESCc1oc(-c2cccs2)nc1C(C)O
InChIInChI=1S/C10H11NO2S/c1-6(12)9-7(2)13-10(11-9)8-4-3-5-14-8/h3-6,12H,1-2H3
InChIKeyNHJTYGLBHYIMJD-UHFFFAOYSA-N
MW209.27 g/mol
LogP2.76
Rot. Bonds2

About 1-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)ethanol

1-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)ethanol (PubChem CID 69240115) has the molecular formula C10H11NO2S and a molecular weight of 209.27 g/mol. Its IUPAC name is 1-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)ethanol.

Molecular Properties

Compound Name1-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)ethanol
PubChem CID69240115
Molecular FormulaC10H11NO2S
Molecular Weight209.27 g/mol
Exact Mass209.05
IUPAC Name1-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)ethanol
SMILESCc1oc(-c2cccs2)nc1C(C)O
InChIInChI=1S/C10H11NO2S/c1-6(12)9-7(2)13-10(11-9)8-4-3-5-14-8/h3-6,12H,1-2H3
InChIKeyNHJTYGLBHYIMJD-UHFFFAOYSA-N
XLogP2.76
TPSA46.26 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.27
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2S,3S)-3-[(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)methylsulfanyl]butan-2-ol
CID 96535838
4-(chloromethyl)-5-methyl-2-thiophen-2-yl-1,3-oxazole
CID 5076491
tert-butyl N-(4-propan-2-yl-2-thiophen-2-yl-1,3-oxazol-5-yl)carbamate
CID 42646660
4-(2-bromoethyl)-5-methyl-2-thiophen-2-yl-1,3-oxazole
CID 23352157
3-methyl-2-[(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)methylamino]butanoic acid
CID 43468711
2-methyl-3-[(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)methylsulfanyl]propanoic acid
CID 64916269
N-[(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)methyl]-1-pyridin-4-ylethanamine
CID 75502429
2-[methyl-[(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)methyl]amino]ethanol
CID 60712307
1-methoxy-3-[methyl-[(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)methyl]amino]propan-2-ol
CID 62015754
4-ethyl-5-methyl-2-(5-methylthiophen-2-yl)-1,3-oxazole;4-ethyl-5-methyl-2-thiophen-2-yl-1,3-oxazole
CID 158381591
N-(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)-5-methyl-2-thiophen-2-yl-1,3-oxazole-4-carboxamide
CID 71938325
3-[(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)methylsulfanyl]propan-1-ol
CID 66128721

Frequently Asked Questions

What is the IUPAC name of 1-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)ethanol?
The IUPAC name of 1-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)ethanol (CID 69240115) is 1-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)ethanol.
What is the SMILES notation for 1-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)ethanol?
The canonical SMILES for 1-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)ethanol is Cc1oc(-c2cccs2)nc1C(C)O.
What is the InChIKey of 1-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)ethanol?
The InChIKey is NHJTYGLBHYIMJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NO2S/c1-6(12)9-7(2)13-10(11-9)8-4-3-5-14-8/h3-6,12H,1-2H3.
What are the key properties of 1-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)ethanol?
1-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)ethanol has a molecular weight of 209.27 g/mol, XLogP of 2.76, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-methyl-2-thiophen-2-yl-1,3-oxazol-4-yl)ethanol is sourced from PubChem (CID 69240115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).