3-[3-(2,3-dihydro-1H-inden-2-yl)-1,2,4-oxadiazol-5-yl]pyrazin-2-amine

C15H13N5O — CID 65414515

IUPAC3-[3-(2,3-dihydro-1H-inden-2-yl)-1,2,4-oxadiazol-5-yl]pyrazin-2-amine
SMILESNc1nccnc1-c1nc(C2Cc3ccccc3C2)no1
InChIInChI=1S/C15H13N5O/c16-13-12(17-5-6-18-13)15-19-14(20-21-15)11-7-9-3-1-2-4-10(9)8-11/h1-6,11H,7-8H2,(H2,16,18)
InChIKeyIYBIJFXTRPKITL-UHFFFAOYSA-N
MW279.30 g/mol
LogP1.99
Rot. Bonds2

About 3-[3-(2,3-dihydro-1H-inden-2-yl)-1,2,4-oxadiazol-5-yl]pyrazin-2-amine

3-[3-(2,3-dihydro-1H-inden-2-yl)-1,2,4-oxadiazol-5-yl]pyrazin-2-amine (PubChem CID 65414515) has the molecular formula C15H13N5O and a molecular weight of 279.30 g/mol. Its IUPAC name is 3-[3-(2,3-dihydro-1H-inden-2-yl)-1,2,4-oxadiazol-5-yl]pyrazin-2-amine.

Molecular Properties

Compound Name3-[3-(2,3-dihydro-1H-inden-2-yl)-1,2,4-oxadiazol-5-yl]pyrazin-2-amine
PubChem CID65414515
Molecular FormulaC15H13N5O
Molecular Weight279.30 g/mol
Exact Mass279.11
IUPAC Name3-[3-(2,3-dihydro-1H-inden-2-yl)-1,2,4-oxadiazol-5-yl]pyrazin-2-amine
SMILESNc1nccnc1-c1nc(C2Cc3ccccc3C2)no1
InChIInChI=1S/C15H13N5O/c16-13-12(17-5-6-18-13)15-19-14(20-21-15)11-7-9-3-1-2-4-10(9)8-11/h1-6,11H,7-8H2,(H2,16,18)
InChIKeyIYBIJFXTRPKITL-UHFFFAOYSA-N
XLogP1.99
TPSA90.72 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.30
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)pyrazin-2-amine
CID 63259990
4-[3-(2,3-dihydro-1H-inden-2-yl)-1,2,4-oxadiazol-5-yl]-1,2,5-oxadiazol-3-amine
CID 65406481
3-[3-(2,3-dihydro-1H-inden-2-yl)-1,2,4-oxadiazol-5-yl]aniline
CID 65415115
4-[3-(2,3-dihydro-1H-inden-2-yl)-1,2,4-oxadiazol-5-yl]pyridin-3-amine
CID 65414106
5-(1-chloroethyl)-3-(2,3-dihydro-1H-inden-2-yl)-1,2,4-oxadiazole
CID 65415290
1-cyclohexyl-4-(5-isoquinolin-1-yl-1,2,4-oxadiazol-3-yl)pyrrolidin-2-one
CID 91916902
1-[3-(2,3-dihydro-1H-inden-2-yl)-1,2,4-oxadiazol-5-yl]-N-methylethanamine
CID 65415723
3-[3-(1H-pyrrol-2-yl)-1,2,4-oxadiazol-5-yl]pyrazin-2-amine
CID 136984377
3-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)pyrazin-2-amine
CID 63260210
3-(1,3-benzoxazol-2-yl)pyrazin-2-amine
CID 67388669
N-cyclopropyl-3-(2,3-dihydro-1H-inden-2-yl)-1,2,4-oxadiazol-5-amine
CID 65405431
2-[3-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-1,2,4-oxadiazol-5-yl]pyridin-3-amine
CID 104743094

Frequently Asked Questions

What is the IUPAC name of 3-[3-(2,3-dihydro-1H-inden-2-yl)-1,2,4-oxadiazol-5-yl]pyrazin-2-amine?
The IUPAC name of 3-[3-(2,3-dihydro-1H-inden-2-yl)-1,2,4-oxadiazol-5-yl]pyrazin-2-amine (CID 65414515) is 3-[3-(2,3-dihydro-1H-inden-2-yl)-1,2,4-oxadiazol-5-yl]pyrazin-2-amine.
What is the SMILES notation for 3-[3-(2,3-dihydro-1H-inden-2-yl)-1,2,4-oxadiazol-5-yl]pyrazin-2-amine?
The canonical SMILES for 3-[3-(2,3-dihydro-1H-inden-2-yl)-1,2,4-oxadiazol-5-yl]pyrazin-2-amine is Nc1nccnc1-c1nc(C2Cc3ccccc3C2)no1.
What is the InChIKey of 3-[3-(2,3-dihydro-1H-inden-2-yl)-1,2,4-oxadiazol-5-yl]pyrazin-2-amine?
The InChIKey is IYBIJFXTRPKITL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N5O/c16-13-12(17-5-6-18-13)15-19-14(20-21-15)11-7-9-3-1-2-4-10(9)8-11/h1-6,11H,7-8H2,(H2,16,18).
What are the key properties of 3-[3-(2,3-dihydro-1H-inden-2-yl)-1,2,4-oxadiazol-5-yl]pyrazin-2-amine?
3-[3-(2,3-dihydro-1H-inden-2-yl)-1,2,4-oxadiazol-5-yl]pyrazin-2-amine has a molecular weight of 279.30 g/mol, XLogP of 1.99, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(2,3-dihydro-1H-inden-2-yl)-1,2,4-oxadiazol-5-yl]pyrazin-2-amine is sourced from PubChem (CID 65414515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).