3-(furan-2-yl)-5-[(2-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methyl]-1,2,4-oxadiazole

C14H15N5O2 — CID 91830701

IUPAC3-(furan-2-yl)-5-[(2-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methyl]-1,2,4-oxadiazole
SMILESCc1cc2n(n1)CCN(Cc1nc(-c3ccco3)no1)C2
InChIInChI=1S/C14H15N5O2/c1-10-7-11-8-18(4-5-19(11)16-10)9-13-15-14(17-21-13)12-3-2-6-20-12/h2-3,6-7H,4-5,8-9H2,1H3
InChIKeyGRYWPAULZLEVRN-UHFFFAOYSA-N
MW285.31 g/mol
LogP1.85
Rot. Bonds3

About 3-(furan-2-yl)-5-[(2-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methyl]-1,2,4-oxadiazole

3-(furan-2-yl)-5-[(2-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methyl]-1,2,4-oxadiazole (PubChem CID 91830701) has the molecular formula C14H15N5O2 and a molecular weight of 285.31 g/mol. Its IUPAC name is 3-(furan-2-yl)-5-[(2-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methyl]-1,2,4-oxadiazole.

Molecular Properties

Compound Name3-(furan-2-yl)-5-[(2-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methyl]-1,2,4-oxadiazole
PubChem CID91830701
Molecular FormulaC14H15N5O2
Molecular Weight285.31 g/mol
Exact Mass285.12
IUPAC Name3-(furan-2-yl)-5-[(2-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methyl]-1,2,4-oxadiazole
SMILESCc1cc2n(n1)CCN(Cc1nc(-c3ccco3)no1)C2
InChIInChI=1S/C14H15N5O2/c1-10-7-11-8-18(4-5-19(11)16-10)9-13-15-14(17-21-13)12-3-2-6-20-12/h2-3,6-7H,4-5,8-9H2,1H3
InChIKeyGRYWPAULZLEVRN-UHFFFAOYSA-N
XLogP1.85
TPSA73.12 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.31
LogP ≤ 51.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 3-(furan-2-yl)-5-[(2-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methyl]-1,2,4-oxadiazole?
The IUPAC name of 3-(furan-2-yl)-5-[(2-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methyl]-1,2,4-oxadiazole (CID 91830701) is 3-(furan-2-yl)-5-[(2-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methyl]-1,2,4-oxadiazole.
What is the SMILES notation for 3-(furan-2-yl)-5-[(2-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methyl]-1,2,4-oxadiazole?
The canonical SMILES for 3-(furan-2-yl)-5-[(2-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methyl]-1,2,4-oxadiazole is Cc1cc2n(n1)CCN(Cc1nc(-c3ccco3)no1)C2.
What is the InChIKey of 3-(furan-2-yl)-5-[(2-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methyl]-1,2,4-oxadiazole?
The InChIKey is GRYWPAULZLEVRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N5O2/c1-10-7-11-8-18(4-5-19(11)16-10)9-13-15-14(17-21-13)12-3-2-6-20-12/h2-3,6-7H,4-5,8-9H2,1H3.
What are the key properties of 3-(furan-2-yl)-5-[(2-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methyl]-1,2,4-oxadiazole?
3-(furan-2-yl)-5-[(2-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methyl]-1,2,4-oxadiazole has a molecular weight of 285.31 g/mol, XLogP of 1.85, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(furan-2-yl)-5-[(2-methyl-6,7-dihydro-4H-pyrazolo[1,5-a]pyrazin-5-yl)methyl]-1,2,4-oxadiazole is sourced from PubChem (CID 91830701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).