3-cyclopropyl-5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-1,2,4-oxadiazole

C12H15N5O — CID 86774602

IUPAC3-cyclopropyl-5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-1,2,4-oxadiazole
SMILESc1cn2c(n1)CN(Cc1nc(C3CC3)no1)CC2
InChIInChI=1S/C12H15N5O/c1-2-9(1)12-14-11(18-15-12)8-16-5-6-17-4-3-13-10(17)7-16/h3-4,9H,1-2,5-8H2
InChIKeyQWPCEDKVCUWAIM-UHFFFAOYSA-N
MW245.29 g/mol
LogP1.16
Rot. Bonds3

About 3-cyclopropyl-5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-1,2,4-oxadiazole

3-cyclopropyl-5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-1,2,4-oxadiazole (PubChem CID 86774602) has the molecular formula C12H15N5O and a molecular weight of 245.29 g/mol. Its IUPAC name is 3-cyclopropyl-5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-1,2,4-oxadiazole.

Molecular Properties

Compound Name3-cyclopropyl-5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-1,2,4-oxadiazole
PubChem CID86774602
Molecular FormulaC12H15N5O
Molecular Weight245.29 g/mol
Exact Mass245.13
IUPAC Name3-cyclopropyl-5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-1,2,4-oxadiazole
SMILESc1cn2c(n1)CN(Cc1nc(C3CC3)no1)CC2
InChIInChI=1S/C12H15N5O/c1-2-9(1)12-14-11(18-15-12)8-16-5-6-17-4-3-13-10(17)7-16/h3-4,9H,1-2,5-8H2
InChIKeyQWPCEDKVCUWAIM-UHFFFAOYSA-N
XLogP1.16
TPSA59.98 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.29
LogP ≤ 51.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 3-cyclopropyl-5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-1,2,4-oxadiazole with MolForge

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Related Compounds

1-(1-ethyl-1H-imidazol-2-yl)-N-methyl-N-{[3-(3-methylbutyl)-1,2,4-oxadiazol-5-yl]methyl}methanamine
CID 16191361
3-cyclohexyl-5-[(2-ethyl-1H-imidazol-1-yl)methyl]-1,2,4-oxadiazole
CID 53164468
5-Cyclopropyl-3-[[3-methyl-4-[(1-methylimidazol-2-yl)methyl]piperazin-1-yl]methyl]-1,2,4-oxadiazole
CID 53566155
5-Cyclopropyl-3-[[4-[(1-methylimidazol-2-yl)methyl]piperazin-1-yl]methyl]-1,2,4-oxadiazole
CID 53567324
1-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methyl]-N-methyl-N-[(1-methylimidazol-2-yl)methyl]piperidin-3-amine
CID 71878603
3-Cyclohexyl-5-[(2-methylimidazol-1-yl)methyl]-1,2,4-oxadiazole
CID 53014740
3-Ethyl-5-[(2-methylimidazol-1-yl)methyl]-1,2,4-oxadiazole
CID 53014747
5-(1H-imidazol-1-ylmethyl)-3-propyl-1,2,4-oxadiazole
CID 53164448
2-[5-(1H-imidazol-1-ylmethyl)-1,2,4-oxadiazol-3-yl]ethyl methyl ether
CID 53164449
3-(2-methoxyethyl)-5-[(2-methyl-1H-imidazol-1-yl)methyl]-1,2,4-oxadiazole
CID 53164459
5-[(2-Ethylimidazol-1-yl)methyl]-3-propyl-1,2,4-oxadiazole
CID 53164482
5-[(2-Ethyl-1H-imidazol-1-YL)methyl]-3-(propan-2-YL)-1,2,4-oxadiazole
CID 53164483

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-1,2,4-oxadiazole?
The IUPAC name of 3-cyclopropyl-5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-1,2,4-oxadiazole (CID 86774602) is 3-cyclopropyl-5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-1,2,4-oxadiazole.
What is the SMILES notation for 3-cyclopropyl-5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-1,2,4-oxadiazole?
The canonical SMILES for 3-cyclopropyl-5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-1,2,4-oxadiazole is c1cn2c(n1)CN(Cc1nc(C3CC3)no1)CC2.
What is the InChIKey of 3-cyclopropyl-5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-1,2,4-oxadiazole?
The InChIKey is QWPCEDKVCUWAIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N5O/c1-2-9(1)12-14-11(18-15-12)8-16-5-6-17-4-3-13-10(17)7-16/h3-4,9H,1-2,5-8H2.
What are the key properties of 3-cyclopropyl-5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-1,2,4-oxadiazole?
3-cyclopropyl-5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-1,2,4-oxadiazole has a molecular weight of 245.29 g/mol, XLogP of 1.16, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-5-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)-1,2,4-oxadiazole is sourced from PubChem (CID 86774602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).