1-[3-(2-methylfuran-3-yl)-1,2,4-oxadiazol-5-yl]cyclopropan-1-amine

C10H11N3O2 — CID 104788996

IUPAC1-[3-(2-methylfuran-3-yl)-1,2,4-oxadiazol-5-yl]cyclopropan-1-amine
SMILESCc1occc1-c1noc(C2(N)CC2)n1
InChIInChI=1S/C10H11N3O2/c1-6-7(2-5-14-6)8-12-9(15-13-8)10(11)3-4-10/h2,5H,3-4,11H2,1H3
InChIKeyJVBAMPRWNZKFAE-UHFFFAOYSA-N
MW205.22 g/mol
LogP1.59
Rot. Bonds2

About 1-[3-(2-methylfuran-3-yl)-1,2,4-oxadiazol-5-yl]cyclopropan-1-amine

1-[3-(2-methylfuran-3-yl)-1,2,4-oxadiazol-5-yl]cyclopropan-1-amine (PubChem CID 104788996) has the molecular formula C10H11N3O2 and a molecular weight of 205.22 g/mol. Its IUPAC name is 1-[3-(2-methylfuran-3-yl)-1,2,4-oxadiazol-5-yl]cyclopropan-1-amine.

Molecular Properties

Compound Name1-[3-(2-methylfuran-3-yl)-1,2,4-oxadiazol-5-yl]cyclopropan-1-amine
PubChem CID104788996
Molecular FormulaC10H11N3O2
Molecular Weight205.22 g/mol
Exact Mass205.09
IUPAC Name1-[3-(2-methylfuran-3-yl)-1,2,4-oxadiazol-5-yl]cyclopropan-1-amine
SMILESCc1occc1-c1noc(C2(N)CC2)n1
InChIInChI=1S/C10H11N3O2/c1-6-7(2-5-14-6)8-12-9(15-13-8)10(11)3-4-10/h2,5H,3-4,11H2,1H3
InChIKeyJVBAMPRWNZKFAE-UHFFFAOYSA-N
XLogP1.59
TPSA78.08 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.22
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-[1-[3-(2-methylfuran-3-yl)-1,2,4-oxadiazol-5-yl]cyclopropyl]aniline
CID 104788863
3-(2-methylfuran-3-yl)-5-(3-methylpyrrolidin-3-yl)-1,2,4-oxadiazole
CID 113453228
5-(3-ethylpiperidin-3-yl)-3-(2-methylfuran-3-yl)-1,2,4-oxadiazole
CID 104788843
1-[3-(2-methylfuran-3-yl)-1,2,4-oxadiazol-5-yl]ethanamine
CID 104788812
1-[3-(4-fluoro-2-methylphenyl)-1,2,4-oxadiazol-5-yl]cyclobutan-1-amine
CID 81274229
1-(3-phenyl-1,2,4-oxadiazol-5-yl)cyclopropan-1-amine;hydrochloride
CID 119947729
1-[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]cyclopentan-1-amine;hydrochloride
CID 119999976
1-[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]cyclopentan-1-amine
CID 62716804
1-[3-(5-fluoro-2-methylphenyl)-1,2,4-oxadiazol-5-yl]cyclopentan-1-amine
CID 62389084
5-(chloromethyl)-3-(2-methylfuran-3-yl)-1,2,4-oxadiazole
CID 104788713
1-[3-(4-methyl-2-pyridinyl)-1,2,4-oxadiazol-5-yl]cyclopentan-1-amine
CID 63839712
4-[3-(4-methylthiophen-3-yl)-1,2,4-oxadiazol-5-yl]oxan-4-amine
CID 113280371

Frequently Asked Questions

What is the IUPAC name of 1-[3-(2-methylfuran-3-yl)-1,2,4-oxadiazol-5-yl]cyclopropan-1-amine?
The IUPAC name of 1-[3-(2-methylfuran-3-yl)-1,2,4-oxadiazol-5-yl]cyclopropan-1-amine (CID 104788996) is 1-[3-(2-methylfuran-3-yl)-1,2,4-oxadiazol-5-yl]cyclopropan-1-amine.
What is the SMILES notation for 1-[3-(2-methylfuran-3-yl)-1,2,4-oxadiazol-5-yl]cyclopropan-1-amine?
The canonical SMILES for 1-[3-(2-methylfuran-3-yl)-1,2,4-oxadiazol-5-yl]cyclopropan-1-amine is Cc1occc1-c1noc(C2(N)CC2)n1.
What is the InChIKey of 1-[3-(2-methylfuran-3-yl)-1,2,4-oxadiazol-5-yl]cyclopropan-1-amine?
The InChIKey is JVBAMPRWNZKFAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O2/c1-6-7(2-5-14-6)8-12-9(15-13-8)10(11)3-4-10/h2,5H,3-4,11H2,1H3.
What are the key properties of 1-[3-(2-methylfuran-3-yl)-1,2,4-oxadiazol-5-yl]cyclopropan-1-amine?
1-[3-(2-methylfuran-3-yl)-1,2,4-oxadiazol-5-yl]cyclopropan-1-amine has a molecular weight of 205.22 g/mol, XLogP of 1.59, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(2-methylfuran-3-yl)-1,2,4-oxadiazol-5-yl]cyclopropan-1-amine is sourced from PubChem (CID 104788996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).