1-[5-(5-methyl-1,2-oxazol-4-yl)-1,3,4-oxadiazol-2-yl]ethanamine

C8H10N4O2 — CID 62070255

IUPAC1-[5-(5-methyl-1,2-oxazol-4-yl)-1,3,4-oxadiazol-2-yl]ethanamine
SMILESCc1oncc1-c1nnc(C(C)N)o1
InChIInChI=1S/C8H10N4O2/c1-4(9)7-11-12-8(13-7)6-3-10-14-5(6)2/h3-4H,9H2,1-2H3
InChIKeyGUKWLCCTXZHKHU-UHFFFAOYSA-N
MW194.19 g/mol
LogP1.05
Rot. Bonds2

About 1-[5-(5-methyl-1,2-oxazol-4-yl)-1,3,4-oxadiazol-2-yl]ethanamine

1-[5-(5-methyl-1,2-oxazol-4-yl)-1,3,4-oxadiazol-2-yl]ethanamine (PubChem CID 62070255) has the molecular formula C8H10N4O2 and a molecular weight of 194.19 g/mol. Its IUPAC name is 1-[5-(5-methyl-1,2-oxazol-4-yl)-1,3,4-oxadiazol-2-yl]ethanamine.

Molecular Properties

Compound Name1-[5-(5-methyl-1,2-oxazol-4-yl)-1,3,4-oxadiazol-2-yl]ethanamine
PubChem CID62070255
Molecular FormulaC8H10N4O2
Molecular Weight194.19 g/mol
Exact Mass194.08
IUPAC Name1-[5-(5-methyl-1,2-oxazol-4-yl)-1,3,4-oxadiazol-2-yl]ethanamine
SMILESCc1oncc1-c1nnc(C(C)N)o1
InChIInChI=1S/C8H10N4O2/c1-4(9)7-11-12-8(13-7)6-3-10-14-5(6)2/h3-4H,9H2,1-2H3
InChIKeyGUKWLCCTXZHKHU-UHFFFAOYSA-N
XLogP1.05
TPSA90.97 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.19
LogP ≤ 51.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

(1S)-1-[5-(2-methylphenyl)-1,3,4-oxadiazol-2-yl]ethanamine
CID 42046774
2-bromo-5-(5-methyl-1,2-oxazol-4-yl)-1,3,4-oxadiazole
CID 114771182
1-[5-(2-bromofuran-3-yl)-1,3,4-oxadiazol-2-yl]ethanamine
CID 106855921
1-(5-methyl-1,2-oxazol-4-yl)ethanamine
CID 43251187
2-(2-chloroethyl)-5-(5-methyl-1,2-oxazol-4-yl)-1,3,4-oxadiazole
CID 43513256
(1S)-1-[5-(3-methylimidazol-4-yl)-1,3,4-oxadiazol-2-yl]ethanamine
CID 82669849
1-[5-(6-methyl-2-pyridinyl)-1,3,4-oxadiazol-2-yl]ethanamine
CID 62070438
1-[5-(2-methyl-5-nitrophenyl)-1,3,4-oxadiazol-2-yl]ethanamine
CID 55035147
1-[5-(4-chloro-2-methoxyphenyl)-1,3,4-oxadiazol-2-yl]ethanamine
CID 55035148
5-(5-methyl-1,2-oxazol-4-yl)-3H-1,3,4-oxadiazole-2-thione
CID 43148570
5-(5-methyl-1,2-oxazol-4-yl)-1,2,4-oxadiazol-3-amine
CID 63692248
(1R)-1-[5-(3-fluorophenyl)-1,3,4-oxadiazol-2-yl]ethanamine
CID 42046788

Frequently Asked Questions

What is the IUPAC name of 1-[5-(5-methyl-1,2-oxazol-4-yl)-1,3,4-oxadiazol-2-yl]ethanamine?
The IUPAC name of 1-[5-(5-methyl-1,2-oxazol-4-yl)-1,3,4-oxadiazol-2-yl]ethanamine (CID 62070255) is 1-[5-(5-methyl-1,2-oxazol-4-yl)-1,3,4-oxadiazol-2-yl]ethanamine.
What is the SMILES notation for 1-[5-(5-methyl-1,2-oxazol-4-yl)-1,3,4-oxadiazol-2-yl]ethanamine?
The canonical SMILES for 1-[5-(5-methyl-1,2-oxazol-4-yl)-1,3,4-oxadiazol-2-yl]ethanamine is Cc1oncc1-c1nnc(C(C)N)o1.
What is the InChIKey of 1-[5-(5-methyl-1,2-oxazol-4-yl)-1,3,4-oxadiazol-2-yl]ethanamine?
The InChIKey is GUKWLCCTXZHKHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N4O2/c1-4(9)7-11-12-8(13-7)6-3-10-14-5(6)2/h3-4H,9H2,1-2H3.
What are the key properties of 1-[5-(5-methyl-1,2-oxazol-4-yl)-1,3,4-oxadiazol-2-yl]ethanamine?
1-[5-(5-methyl-1,2-oxazol-4-yl)-1,3,4-oxadiazol-2-yl]ethanamine has a molecular weight of 194.19 g/mol, XLogP of 1.05, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(5-methyl-1,2-oxazol-4-yl)-1,3,4-oxadiazol-2-yl]ethanamine is sourced from PubChem (CID 62070255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).