[3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-3-methylpiperidin-1-yl]-(5-cyclopropyl-1H-pyrazol-3-yl)methanone

C18H23N5O2 — CID 91888319

IUPAC[3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-3-methylpiperidin-1-yl]-(5-cyclopropyl-1H-pyrazol-3-yl)methanone
SMILESCC1(c2nc(C3CC3)no2)CCCN(C(=O)c2cc(C3CC3)[nH]n2)C1
InChIInChI=1S/C18H23N5O2/c1-18(17-19-15(22-25-17)12-5-6-12)7-2-8-23(10-18)16(24)14-9-13(20-21-14)11-3-4-11/h9,11-12H,2-8,10H2,1H3,(H,20,21)
InChIKeyAFISOXKQMDONDC-UHFFFAOYSA-N
MW341.42 g/mol
LogP2.74
Rot. Bonds4

About [3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-3-methylpiperidin-1-yl]-(5-cyclopropyl-1H-pyrazol-3-yl)methanone

[3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-3-methylpiperidin-1-yl]-(5-cyclopropyl-1H-pyrazol-3-yl)methanone (PubChem CID 91888319) has the molecular formula C18H23N5O2 and a molecular weight of 341.42 g/mol. Its IUPAC name is [3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-3-methylpiperidin-1-yl]-(5-cyclopropyl-1H-pyrazol-3-yl)methanone.

Molecular Properties

Compound Name[3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-3-methylpiperidin-1-yl]-(5-cyclopropyl-1H-pyrazol-3-yl)methanone
PubChem CID91888319
Molecular FormulaC18H23N5O2
Molecular Weight341.42 g/mol
Exact Mass341.19
IUPAC Name[3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-3-methylpiperidin-1-yl]-(5-cyclopropyl-1H-pyrazol-3-yl)methanone
SMILESCC1(c2nc(C3CC3)no2)CCCN(C(=O)c2cc(C3CC3)[nH]n2)C1
InChIInChI=1S/C18H23N5O2/c1-18(17-19-15(22-25-17)12-5-6-12)7-2-8-23(10-18)16(24)14-9-13(20-21-14)11-3-4-11/h9,11-12H,2-8,10H2,1H3,(H,20,21)
InChIKeyAFISOXKQMDONDC-UHFFFAOYSA-N
XLogP2.74
TPSA87.91 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.42
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze [3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-3-methylpiperidin-1-yl]-(5-cyclopropyl-1H-pyrazol-3-yl)methanone 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

7-(5-cyclohexyl-1H-pyrazole-3-carbonyl)-8a-methyl-1,5,6,8-tetrahydro-[1,3]oxazolo[3,4-a]pyrazin-3-one
CID 155959274
(5-cyclopropyl-1H-pyrazol-3-yl)-[3-[5-(furan-2-yl)-1,2,4-oxadiazol-3-yl]pyrrolidin-1-yl]methanone
CID 121019667
(5-cyclopropyl-1H-pyrazol-3-yl)-[3-(1,2,4-oxadiazol-3-yl)pyrrolidin-1-yl]methanone
CID 121019587
[(2S)-2-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-4,4-difluoropyrrolidin-1-yl]-(5-cyclopropyl-1H-pyrazol-3-yl)methanone
CID 110203127
(5-cyclohexyl-1H-pyrazol-3-yl)-(2,2-dimethyl-1-oxo-1,4-thiazinan-4-yl)methanone
CID 119033587
(5-cyclopropyl-1H-pyrazol-3-yl)-[(3S)-3-hydroxy-3-(1-propan-2-yltriazol-4-yl)piperidin-1-yl]methanone
CID 129484291
[3-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-(1-methylpyrazol-3-yl)methanone
CID 110257094
[3-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]-pyrazin-2-ylmethanone
CID 110256988
(5-cyclopropyl-1H-pyrazol-3-yl)-[(3S)-3-[3-(2-methylpropyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]methanone
CID 95227905
[(3aR,4R,7S,7aS)-1,3,3a,4,5,6,7,7a-octahydro-4,7-epoxyisoindol-2-yl]-(5-cyclopropyl-1H-pyrazol-3-yl)methanone
CID 56872114
(5-cyclopropyl-1H-pyrazol-3-yl)-(3-ethoxypiperidin-1-yl)methanone
CID 47403831
(5-cyclopropyl-1H-pyrazol-3-yl)-[(3S)-3-ethoxypiperidin-1-yl]methanone
CID 94199651

Frequently Asked Questions

What is the IUPAC name of [3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-3-methylpiperidin-1-yl]-(5-cyclopropyl-1H-pyrazol-3-yl)methanone?
The IUPAC name of [3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-3-methylpiperidin-1-yl]-(5-cyclopropyl-1H-pyrazol-3-yl)methanone (CID 91888319) is [3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-3-methylpiperidin-1-yl]-(5-cyclopropyl-1H-pyrazol-3-yl)methanone.
What is the SMILES notation for [3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-3-methylpiperidin-1-yl]-(5-cyclopropyl-1H-pyrazol-3-yl)methanone?
The canonical SMILES for [3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-3-methylpiperidin-1-yl]-(5-cyclopropyl-1H-pyrazol-3-yl)methanone is CC1(c2nc(C3CC3)no2)CCCN(C(=O)c2cc(C3CC3)[nH]n2)C1.
What is the InChIKey of [3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-3-methylpiperidin-1-yl]-(5-cyclopropyl-1H-pyrazol-3-yl)methanone?
The InChIKey is AFISOXKQMDONDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N5O2/c1-18(17-19-15(22-25-17)12-5-6-12)7-2-8-23(10-18)16(24)14-9-13(20-21-14)11-3-4-11/h9,11-12H,2-8,10H2,1H3,(H,20,21).
What are the key properties of [3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-3-methylpiperidin-1-yl]-(5-cyclopropyl-1H-pyrazol-3-yl)methanone?
[3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-3-methylpiperidin-1-yl]-(5-cyclopropyl-1H-pyrazol-3-yl)methanone has a molecular weight of 341.42 g/mol, XLogP of 2.74, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-3-methylpiperidin-1-yl]-(5-cyclopropyl-1H-pyrazol-3-yl)methanone is sourced from PubChem (CID 91888319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).