2-[5-(2-aminoethyl)-1,3-oxazol-2-yl]ethanol

C7H12N2O2 — CID 115084892

IUPAC2-[5-(2-aminoethyl)-1,3-oxazol-2-yl]ethanol
SMILESNCCc1cnc(CCO)o1
InChIInChI=1S/C7H12N2O2/c8-3-1-6-5-9-7(11-6)2-4-10/h5,10H,1-4,8H2
InChIKeyCCIRKLLIBROSPY-UHFFFAOYSA-N
MW156.18 g/mol
LogP-0.29
Rot. Bonds4

About 2-[5-(2-aminoethyl)-1,3-oxazol-2-yl]ethanol

2-[5-(2-aminoethyl)-1,3-oxazol-2-yl]ethanol (PubChem CID 115084892) has the molecular formula C7H12N2O2 and a molecular weight of 156.18 g/mol. Its IUPAC name is 2-[5-(2-aminoethyl)-1,3-oxazol-2-yl]ethanol.

Molecular Properties

Compound Name2-[5-(2-aminoethyl)-1,3-oxazol-2-yl]ethanol
PubChem CID115084892
Molecular FormulaC7H12N2O2
Molecular Weight156.18 g/mol
Exact Mass156.09
IUPAC Name2-[5-(2-aminoethyl)-1,3-oxazol-2-yl]ethanol
SMILESNCCc1cnc(CCO)o1
InChIInChI=1S/C7H12N2O2/c8-3-1-6-5-9-7(11-6)2-4-10/h5,10H,1-4,8H2
InChIKeyCCIRKLLIBROSPY-UHFFFAOYSA-N
XLogP-0.29
TPSA72.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.18
LogP ≤ 5-0.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-(fluoromethyl)-1,3-oxazol-5-yl]ethanamine
CID 84762830
2-(5-propyl-1,3-oxazol-2-yl)ethanamine
CID 65178585
3-[5-(aminomethyl)-1,3-oxazol-2-yl]propan-1-ol
CID 115084839
2-(5-ethyl-1,3-oxazol-2-yl)ethanamine;hydrochloride
CID 66588553
2-[5-(2-phenylethyl)-1,3-oxazol-2-yl]ethanamine
CID 65178534
2-[2-(piperidin-4-ylmethyl)-1,3-oxazol-5-yl]ethanamine
CID 115085458
2-[5-(cyclohexylmethyl)-1,3-oxazol-2-yl]ethanamine
CID 65178972
2-[5-(2,3,3-trimethylbutyl)-1,3-oxazol-2-yl]ethanamine
CID 65178751
2-(2-methylsulfanyl-1,3-oxazol-5-yl)ethanamine;hydrochloride
CID 68522489
3-[2-[2-(4-fluorophenyl)ethyl]-1,3-oxazol-5-yl]propan-1-amine
CID 112518620
2,5-dipentyl-1,3-oxazole
CID 67264472
3-(5-benzyl-1,3-oxazol-2-yl)propan-1-amine
CID 115004084

Frequently Asked Questions

What is the IUPAC name of 2-[5-(2-aminoethyl)-1,3-oxazol-2-yl]ethanol?
The IUPAC name of 2-[5-(2-aminoethyl)-1,3-oxazol-2-yl]ethanol (CID 115084892) is 2-[5-(2-aminoethyl)-1,3-oxazol-2-yl]ethanol.
What is the SMILES notation for 2-[5-(2-aminoethyl)-1,3-oxazol-2-yl]ethanol?
The canonical SMILES for 2-[5-(2-aminoethyl)-1,3-oxazol-2-yl]ethanol is NCCc1cnc(CCO)o1.
What is the InChIKey of 2-[5-(2-aminoethyl)-1,3-oxazol-2-yl]ethanol?
The InChIKey is CCIRKLLIBROSPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2O2/c8-3-1-6-5-9-7(11-6)2-4-10/h5,10H,1-4,8H2.
What are the key properties of 2-[5-(2-aminoethyl)-1,3-oxazol-2-yl]ethanol?
2-[5-(2-aminoethyl)-1,3-oxazol-2-yl]ethanol has a molecular weight of 156.18 g/mol, XLogP of -0.29, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(2-aminoethyl)-1,3-oxazol-2-yl]ethanol is sourced from PubChem (CID 115084892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).