2-(1-cyclopropylpiperidin-4-yl)-5-(1-propan-2-ylindazol-3-yl)-1,3,4-oxadiazole

C20H25N5O — CID 71536212

IUPAC2-(1-cyclopropylpiperidin-4-yl)-5-(1-propan-2-ylindazol-3-yl)-1,3,4-oxadiazole
SMILESCC(C)n1nc(-c2nnc(C3CCN(C4CC4)CC3)o2)c2ccccc21
InChIInChI=1S/C20H25N5O/c1-13(2)25-17-6-4-3-5-16(17)18(23-25)20-22-21-19(26-20)14-9-11-24(12-10-14)15-7-8-15/h3-6,13-15H,7-12H2,1-2H3
InChIKeyJTRVNNILEYAXKB-UHFFFAOYSA-N
MW351.45 g/mol
LogP4.01
Rot. Bonds4

About 2-(1-cyclopropylpiperidin-4-yl)-5-(1-propan-2-ylindazol-3-yl)-1,3,4-oxadiazole

2-(1-cyclopropylpiperidin-4-yl)-5-(1-propan-2-ylindazol-3-yl)-1,3,4-oxadiazole (PubChem CID 71536212) has the molecular formula C20H25N5O and a molecular weight of 351.45 g/mol. Its IUPAC name is 2-(1-cyclopropylpiperidin-4-yl)-5-(1-propan-2-ylindazol-3-yl)-1,3,4-oxadiazole.

Molecular Properties

Compound Name2-(1-cyclopropylpiperidin-4-yl)-5-(1-propan-2-ylindazol-3-yl)-1,3,4-oxadiazole
PubChem CID71536212
Molecular FormulaC20H25N5O
Molecular Weight351.45 g/mol
Exact Mass351.21
IUPAC Name2-(1-cyclopropylpiperidin-4-yl)-5-(1-propan-2-ylindazol-3-yl)-1,3,4-oxadiazole
SMILESCC(C)n1nc(-c2nnc(C3CCN(C4CC4)CC3)o2)c2ccccc21
InChIInChI=1S/C20H25N5O/c1-13(2)25-17-6-4-3-5-16(17)18(23-25)20-22-21-19(26-20)14-9-11-24(12-10-14)15-7-8-15/h3-6,13-15H,7-12H2,1-2H3
InChIKeyJTRVNNILEYAXKB-UHFFFAOYSA-N
XLogP4.01
TPSA59.98 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.45
LogP ≤ 54.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 2-(1-cyclopropylpiperidin-4-yl)-5-(1-propan-2-ylindazol-3-yl)-1,3,4-oxadiazole with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(1-cyclopropylpiperidin-4-yl)-5-(1-propan-2-ylindazol-3-yl)-1,3,4-oxadiazole?
The IUPAC name of 2-(1-cyclopropylpiperidin-4-yl)-5-(1-propan-2-ylindazol-3-yl)-1,3,4-oxadiazole (CID 71536212) is 2-(1-cyclopropylpiperidin-4-yl)-5-(1-propan-2-ylindazol-3-yl)-1,3,4-oxadiazole.
What is the SMILES notation for 2-(1-cyclopropylpiperidin-4-yl)-5-(1-propan-2-ylindazol-3-yl)-1,3,4-oxadiazole?
The canonical SMILES for 2-(1-cyclopropylpiperidin-4-yl)-5-(1-propan-2-ylindazol-3-yl)-1,3,4-oxadiazole is CC(C)n1nc(-c2nnc(C3CCN(C4CC4)CC3)o2)c2ccccc21.
What is the InChIKey of 2-(1-cyclopropylpiperidin-4-yl)-5-(1-propan-2-ylindazol-3-yl)-1,3,4-oxadiazole?
The InChIKey is JTRVNNILEYAXKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N5O/c1-13(2)25-17-6-4-3-5-16(17)18(23-25)20-22-21-19(26-20)14-9-11-24(12-10-14)15-7-8-15/h3-6,13-15H,7-12H2,1-2H3.
What are the key properties of 2-(1-cyclopropylpiperidin-4-yl)-5-(1-propan-2-ylindazol-3-yl)-1,3,4-oxadiazole?
2-(1-cyclopropylpiperidin-4-yl)-5-(1-propan-2-ylindazol-3-yl)-1,3,4-oxadiazole has a molecular weight of 351.45 g/mol, XLogP of 4.01, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-cyclopropylpiperidin-4-yl)-5-(1-propan-2-ylindazol-3-yl)-1,3,4-oxadiazole is sourced from PubChem (CID 71536212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).