5-(2-methylcyclopropyl)-3-(1,2-oxazol-3-ylmethyl)-1,2,4-oxadiazole

C10H11N3O2 — CID 119033967

IUPAC5-(2-methylcyclopropyl)-3-(1,2-oxazol-3-ylmethyl)-1,2,4-oxadiazole
SMILESCC1CC1c1nc(Cc2ccon2)no1
InChIInChI=1S/C10H11N3O2/c1-6-4-8(6)10-11-9(13-15-10)5-7-2-3-14-12-7/h2-3,6,8H,4-5H2,1H3
InChIKeySVICDIXFJRILMZ-UHFFFAOYSA-N
MW205.22 g/mol
LogP1.77
Rot. Bonds3

About 5-(2-methylcyclopropyl)-3-(1,2-oxazol-3-ylmethyl)-1,2,4-oxadiazole

5-(2-methylcyclopropyl)-3-(1,2-oxazol-3-ylmethyl)-1,2,4-oxadiazole (PubChem CID 119033967) has the molecular formula C10H11N3O2 and a molecular weight of 205.22 g/mol. Its IUPAC name is 5-(2-methylcyclopropyl)-3-(1,2-oxazol-3-ylmethyl)-1,2,4-oxadiazole.

Molecular Properties

Compound Name5-(2-methylcyclopropyl)-3-(1,2-oxazol-3-ylmethyl)-1,2,4-oxadiazole
PubChem CID119033967
Molecular FormulaC10H11N3O2
Molecular Weight205.22 g/mol
Exact Mass205.09
IUPAC Name5-(2-methylcyclopropyl)-3-(1,2-oxazol-3-ylmethyl)-1,2,4-oxadiazole
SMILESCC1CC1c1nc(Cc2ccon2)no1
InChIInChI=1S/C10H11N3O2/c1-6-4-8(6)10-11-9(13-15-10)5-7-2-3-14-12-7/h2-3,6,8H,4-5H2,1H3
InChIKeySVICDIXFJRILMZ-UHFFFAOYSA-N
XLogP1.77
TPSA64.95 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.22
LogP ≤ 51.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

5-[(1R,2R)-2-naphthalen-2-ylcyclopropyl]-3-(1,2-oxazol-3-ylmethyl)-1,2,4-oxadiazole
CID 100691260
5-(2-methylcyclopropyl)-3-(methylsulfinylmethyl)-1,2,4-oxadiazole
CID 130634390
3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-5-[(1R,2S)-2-(2-methylphenyl)cyclopropyl]-1,2,4-oxadiazole
CID 97072785
3-[(2-ethylbenzimidazol-1-yl)methyl]-5-[(1R,2R)-2-methylcyclopropyl]-1,2,4-oxadiazole
CID 100695418
3-[(2-ethylbenzimidazol-1-yl)methyl]-5-[(1R,2S)-2-methylcyclopropyl]-1,2,4-oxadiazole
CID 100695399
5-(2-methylpyrrolidin-3-yl)-3-(pyridin-3-ylmethyl)-1,2,4-oxadiazole
CID 79372126
5-[(1R,2R)-2-methylcyclopropyl]-3-(5-methyl-1,3-oxazol-4-yl)-1,2,4-oxadiazole
CID 100677190
5-[(1R,2S)-2-methylcyclopropyl]-3-pyridin-3-yl-1,2,4-oxadiazole
CID 100676956
2-[3-(pyridin-3-ylmethyl)-1,2,4-oxadiazol-5-yl]cyclopropane-1-carboxylic acid
CID 62550871
5-[(1S,2R)-2-(furan-2-yl)cyclopropyl]-3-[(3-methylimidazol-4-yl)methyl]-1,2,4-oxadiazole
CID 100693651
3-[[5-[(1R,2R)-2-(4-bromophenyl)cyclopropyl]-1,2,4-oxadiazol-3-yl]methyl]-5-methyl-1,2,4-oxadiazole
CID 166235865
3-[5-(2-methylcyclopropyl)-1,2,4-oxadiazol-3-yl]aniline
CID 43525244

Frequently Asked Questions

What is the IUPAC name of 5-(2-methylcyclopropyl)-3-(1,2-oxazol-3-ylmethyl)-1,2,4-oxadiazole?
The IUPAC name of 5-(2-methylcyclopropyl)-3-(1,2-oxazol-3-ylmethyl)-1,2,4-oxadiazole (CID 119033967) is 5-(2-methylcyclopropyl)-3-(1,2-oxazol-3-ylmethyl)-1,2,4-oxadiazole.
What is the SMILES notation for 5-(2-methylcyclopropyl)-3-(1,2-oxazol-3-ylmethyl)-1,2,4-oxadiazole?
The canonical SMILES for 5-(2-methylcyclopropyl)-3-(1,2-oxazol-3-ylmethyl)-1,2,4-oxadiazole is CC1CC1c1nc(Cc2ccon2)no1.
What is the InChIKey of 5-(2-methylcyclopropyl)-3-(1,2-oxazol-3-ylmethyl)-1,2,4-oxadiazole?
The InChIKey is SVICDIXFJRILMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O2/c1-6-4-8(6)10-11-9(13-15-10)5-7-2-3-14-12-7/h2-3,6,8H,4-5H2,1H3.
What are the key properties of 5-(2-methylcyclopropyl)-3-(1,2-oxazol-3-ylmethyl)-1,2,4-oxadiazole?
5-(2-methylcyclopropyl)-3-(1,2-oxazol-3-ylmethyl)-1,2,4-oxadiazole has a molecular weight of 205.22 g/mol, XLogP of 1.77, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methylcyclopropyl)-3-(1,2-oxazol-3-ylmethyl)-1,2,4-oxadiazole is sourced from PubChem (CID 119033967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).