[(2R)-2-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-pyridin-4-ylmethanone

C17H16N6O2 — CID 95110744

IUPAC[(2R)-2-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-pyridin-4-ylmethanone
SMILESO=C(c1ccncc1)N1CCCC[C@@H]1c1nc(-c2cnccn2)no1
InChIInChI=1S/C17H16N6O2/c24-17(12-4-6-18-7-5-12)23-10-2-1-3-14(23)16-21-15(22-25-16)13-11-19-8-9-20-13/h4-9,11,14H,1-3,10H2/t14-/m1/s1
InChIKeyUHTYQHROLCBQEL-CQSZACIVSA-N
MW336.36 g/mol
LogP2.29
Rot. Bonds3

About [(2R)-2-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-pyridin-4-ylmethanone

[(2R)-2-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-pyridin-4-ylmethanone (PubChem CID 95110744) has the molecular formula C17H16N6O2 and a molecular weight of 336.36 g/mol. Its IUPAC name is [(2R)-2-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-pyridin-4-ylmethanone.

Molecular Properties

Compound Name[(2R)-2-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-pyridin-4-ylmethanone
PubChem CID95110744
Molecular FormulaC17H16N6O2
Molecular Weight336.36 g/mol
Exact Mass336.13
IUPAC Name[(2R)-2-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-pyridin-4-ylmethanone
SMILESO=C(c1ccncc1)N1CCCC[C@@H]1c1nc(-c2cnccn2)no1
InChIInChI=1S/C17H16N6O2/c24-17(12-4-6-18-7-5-12)23-10-2-1-3-14(23)16-21-15(22-25-16)13-11-19-8-9-20-13/h4-9,11,14H,1-3,10H2/t14-/m1/s1
InChIKeyUHTYQHROLCBQEL-CQSZACIVSA-N
XLogP2.29
TPSA97.90 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.36
LogP ≤ 52.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze [(2R)-2-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-pyridin-4-ylmethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

pyrazin-2-yl-[2-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]methanone
CID 53192003
[2-(3-phenyl-1,2,4-oxadiazol-5-yl)pyrrolidin-1-yl]-pyridin-4-ylmethanone
CID 91888691
5-[(2S)-1-benzylpyrrolidin-2-yl]-3-pyrazin-2-yl-1,2,4-oxadiazole
CID 97071015
(6-methyl-3-pyridinyl)-[2-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]methanone
CID 53192007
(6-methyl-3-pyridinyl)-[(2R)-2-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]methanone
CID 95110782
(4-chlorophenyl)-[2-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]methanone
CID 4240880
[2-[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl]-phenylmethanone
CID 91888614
[(2R)-2-(3-ethyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-pyrazin-2-ylmethanone
CID 95110659
[(2R)-2-(3-phenyl-1,2,4-oxadiazol-5-yl)pyrrolidin-1-yl]-quinoxalin-6-ylmethanone
CID 96575674
(6-methyl-3-pyridinyl)-[(2R)-2-(3-phenyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]methanone
CID 95286685
[2-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]-[4-(trifluoromethyl)phenyl]methanone
CID 3369474
phenyl-[(2R)-2-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)azetidin-1-yl]methanone
CID 92573988

Frequently Asked Questions

What is the IUPAC name of [(2R)-2-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-pyridin-4-ylmethanone?
The IUPAC name of [(2R)-2-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-pyridin-4-ylmethanone (CID 95110744) is [(2R)-2-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-pyridin-4-ylmethanone.
What is the SMILES notation for [(2R)-2-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-pyridin-4-ylmethanone?
The canonical SMILES for [(2R)-2-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-pyridin-4-ylmethanone is O=C(c1ccncc1)N1CCCC[C@@H]1c1nc(-c2cnccn2)no1.
What is the InChIKey of [(2R)-2-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-pyridin-4-ylmethanone?
The InChIKey is UHTYQHROLCBQEL-CQSZACIVSA-N. The full InChI is InChI=1S/C17H16N6O2/c24-17(12-4-6-18-7-5-12)23-10-2-1-3-14(23)16-21-15(22-25-16)13-11-19-8-9-20-13/h4-9,11,14H,1-3,10H2/t14-/m1/s1.
What are the key properties of [(2R)-2-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-pyridin-4-ylmethanone?
[(2R)-2-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-pyridin-4-ylmethanone has a molecular weight of 336.36 g/mol, XLogP of 2.29, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-2-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-pyridin-4-ylmethanone is sourced from PubChem (CID 95110744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).