3-cyclopropyl-5-[6-[4-(pyrazol-1-ylmethyl)piperidin-1-yl]-3-pyridinyl]-1,2,4-oxadiazole

C19H22N6O — CID 25277718

IUPAC3-cyclopropyl-5-[6-[4-(pyrazol-1-ylmethyl)piperidin-1-yl]-3-pyridinyl]-1,2,4-oxadiazole
SMILESc1cnn(CC2CCN(c3ccc(-c4nc(C5CC5)no4)cn3)CC2)c1
InChIInChI=1S/C19H22N6O/c1-8-21-25(9-1)13-14-6-10-24(11-7-14)17-5-4-16(12-20-17)19-22-18(23-26-19)15-2-3-15/h1,4-5,8-9,12,14-15H,2-3,6-7,10-11,13H2
InChIKeyRHNMGASDFJKVMT-UHFFFAOYSA-N
MW350.43 g/mol
LogP3.12
Rot. Bonds5

About 3-cyclopropyl-5-[6-[4-(pyrazol-1-ylmethyl)piperidin-1-yl]-3-pyridinyl]-1,2,4-oxadiazole

3-cyclopropyl-5-[6-[4-(pyrazol-1-ylmethyl)piperidin-1-yl]-3-pyridinyl]-1,2,4-oxadiazole (PubChem CID 25277718) has the molecular formula C19H22N6O and a molecular weight of 350.43 g/mol. Its IUPAC name is 3-cyclopropyl-5-[6-[4-(pyrazol-1-ylmethyl)piperidin-1-yl]-3-pyridinyl]-1,2,4-oxadiazole.

Molecular Properties

Compound Name3-cyclopropyl-5-[6-[4-(pyrazol-1-ylmethyl)piperidin-1-yl]-3-pyridinyl]-1,2,4-oxadiazole
PubChem CID25277718
Molecular FormulaC19H22N6O
Molecular Weight350.43 g/mol
Exact Mass350.19
IUPAC Name3-cyclopropyl-5-[6-[4-(pyrazol-1-ylmethyl)piperidin-1-yl]-3-pyridinyl]-1,2,4-oxadiazole
SMILESc1cnn(CC2CCN(c3ccc(-c4nc(C5CC5)no4)cn3)CC2)c1
InChIInChI=1S/C19H22N6O/c1-8-21-25(9-1)13-14-6-10-24(11-7-14)17-5-4-16(12-20-17)19-22-18(23-26-19)15-2-3-15/h1,4-5,8-9,12,14-15H,2-3,6-7,10-11,13H2
InChIKeyRHNMGASDFJKVMT-UHFFFAOYSA-N
XLogP3.12
TPSA72.87 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.43
LogP ≤ 53.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 3-cyclopropyl-5-[6-[4-(pyrazol-1-ylmethyl)piperidin-1-yl]-3-pyridinyl]-1,2,4-oxadiazole with MolForge

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Related Compounds

1-[5-(3-methyl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]piperidin-4-ol
CID 56769826
1-[5-(3-methyl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]piperidin-4-amine
CID 56686570
1-[5-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]piperidin-4-ol
CID 56769912
6-[4-(pyrazol-1-ylmethyl)piperidin-1-yl]pyridine-2-carboxylic acid
CID 122048040
1-[5-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-2-pyridinyl]piperidin-4-ol
CID 56769930
3-(4-methylphenyl)-5-[6-(4-methylpiperidin-1-yl)-3-pyridinyl]-1,2,4-oxadiazole
CID 53037167
1-[5-[3-(3-phenylpropyl)-1,2,4-oxadiazol-5-yl]-2-pyridinyl]piperidin-4-ol
CID 70753740
1-[5-(3-phenyl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]pyrrolidin-3-amine
CID 56769882
[4-[5-[6-(4-methylpiperidin-1-yl)-3-pyridinyl]-1,2,4-oxadiazol-3-yl]phenyl]methanamine;hydrochloride
CID 120892380
[6-[(3R)-3-(hydroxymethyl)pyrrolidin-1-yl]-3-pyridinyl]-[4-(pyrazol-1-ylmethyl)piperidin-1-yl]methanone
CID 95193057
1-[5-(3-methyl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]pyrrolidin-3-amine
CID 56686574
3-[(3S)-oxolan-3-yl]-5-[3-(pyrazol-1-ylmethyl)phenyl]-1,2,4-oxadiazole
CID 97438197

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-5-[6-[4-(pyrazol-1-ylmethyl)piperidin-1-yl]-3-pyridinyl]-1,2,4-oxadiazole?
The IUPAC name of 3-cyclopropyl-5-[6-[4-(pyrazol-1-ylmethyl)piperidin-1-yl]-3-pyridinyl]-1,2,4-oxadiazole (CID 25277718) is 3-cyclopropyl-5-[6-[4-(pyrazol-1-ylmethyl)piperidin-1-yl]-3-pyridinyl]-1,2,4-oxadiazole.
What is the SMILES notation for 3-cyclopropyl-5-[6-[4-(pyrazol-1-ylmethyl)piperidin-1-yl]-3-pyridinyl]-1,2,4-oxadiazole?
The canonical SMILES for 3-cyclopropyl-5-[6-[4-(pyrazol-1-ylmethyl)piperidin-1-yl]-3-pyridinyl]-1,2,4-oxadiazole is c1cnn(CC2CCN(c3ccc(-c4nc(C5CC5)no4)cn3)CC2)c1.
What is the InChIKey of 3-cyclopropyl-5-[6-[4-(pyrazol-1-ylmethyl)piperidin-1-yl]-3-pyridinyl]-1,2,4-oxadiazole?
The InChIKey is RHNMGASDFJKVMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N6O/c1-8-21-25(9-1)13-14-6-10-24(11-7-14)17-5-4-16(12-20-17)19-22-18(23-26-19)15-2-3-15/h1,4-5,8-9,12,14-15H,2-3,6-7,10-11,13H2.
What are the key properties of 3-cyclopropyl-5-[6-[4-(pyrazol-1-ylmethyl)piperidin-1-yl]-3-pyridinyl]-1,2,4-oxadiazole?
3-cyclopropyl-5-[6-[4-(pyrazol-1-ylmethyl)piperidin-1-yl]-3-pyridinyl]-1,2,4-oxadiazole has a molecular weight of 350.43 g/mol, XLogP of 3.12, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-5-[6-[4-(pyrazol-1-ylmethyl)piperidin-1-yl]-3-pyridinyl]-1,2,4-oxadiazole is sourced from PubChem (CID 25277718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).