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

C20H27N5O — CID 71536209

IUPAC2-(1-propan-2-ylindazol-3-yl)-5-(1-propan-2-ylpiperidin-4-yl)-1,3,4-oxadiazole
SMILESCC(C)N1CCC(c2nnc(-c3nn(C(C)C)c4ccccc34)o2)CC1
InChIInChI=1S/C20H27N5O/c1-13(2)24-11-9-15(10-12-24)19-21-22-20(26-19)18-16-7-5-6-8-17(16)25(23-18)14(3)4/h5-8,13-15H,9-12H2,1-4H3
InChIKeyHUYJRMFAFYNTRY-UHFFFAOYSA-N
MW353.47 g/mol
LogP4.26
Rot. Bonds4

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

2-(1-propan-2-ylindazol-3-yl)-5-(1-propan-2-ylpiperidin-4-yl)-1,3,4-oxadiazole (PubChem CID 71536209) has the molecular formula C20H27N5O and a molecular weight of 353.47 g/mol. Its IUPAC name is 2-(1-propan-2-ylindazol-3-yl)-5-(1-propan-2-ylpiperidin-4-yl)-1,3,4-oxadiazole.

Molecular Properties

Compound Name2-(1-propan-2-ylindazol-3-yl)-5-(1-propan-2-ylpiperidin-4-yl)-1,3,4-oxadiazole
PubChem CID71536209
Molecular FormulaC20H27N5O
Molecular Weight353.47 g/mol
Exact Mass353.22
IUPAC Name2-(1-propan-2-ylindazol-3-yl)-5-(1-propan-2-ylpiperidin-4-yl)-1,3,4-oxadiazole
SMILESCC(C)N1CCC(c2nnc(-c3nn(C(C)C)c4ccccc34)o2)CC1
InChIInChI=1S/C20H27N5O/c1-13(2)24-11-9-15(10-12-24)19-21-22-20(26-19)18-16-7-5-6-8-17(16)25(23-18)14(3)4/h5-8,13-15H,9-12H2,1-4H3
InChIKeyHUYJRMFAFYNTRY-UHFFFAOYSA-N
XLogP4.26
TPSA59.98 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.47
LogP ≤ 54.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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

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Related Compounds

Suvn-d4010
CID 71508291
Mfubinac
CID 58124744
(1S,7aR)-hexahydro-1H-pyrrolizin-1-ylmethyl 1-methyl-1Hindazole-3-carboxylate
CID 11522273
3-[5-(1-Cyclobutylmethyl-piperidin-4-yl)-[1,3,4]oxadiazol-2-yl]-1-isopropyl-1H-indazole
CID 71536206
3-[5-(1-Cyclopropylmethyl-piperidin-4-yl)-[1,3,4]oxadiazol-2-yl]-1-isopropyl-1H-indazole
CID 71536210
3-[5-(1-Cyclopentyl-piperidin-4-yl)-[1,3,4]oxadiazol-2-yl]-1-isopropyl-1H-indazole
CID 71536468
1-Isopropyl-3-{5-[1-(tetrahydro-pyran-4-yl)-piperidin-4-yl]-[1,3,4]oxadiazol-2-yl}-1H-indazole
CID 71536747
Propyl 1-benzoylindazole-3-carboxylate
CID 56659693
Ethyl 1-(cyclopentanecarbonyl)indazole-3-carboxylate
CID 56666607
5-HT4R agonist-1
CID 138376515
2-[1-(3-Methoxypropyl)piperidin-4-yl]-5-(2-propan-2-ylpyrazolo[1,5-a]pyridin-7-yl)-1,3,4-oxadiazole
CID 145972573
2-(1-Propan-2-ylpiperidin-4-yl)-5-(2-propan-2-ylpyrazolo[1,5-a]pyridin-7-yl)-1,3,4-oxadiazole
CID 145975297

Frequently Asked Questions

What is the IUPAC name of 2-(1-propan-2-ylindazol-3-yl)-5-(1-propan-2-ylpiperidin-4-yl)-1,3,4-oxadiazole?
The IUPAC name of 2-(1-propan-2-ylindazol-3-yl)-5-(1-propan-2-ylpiperidin-4-yl)-1,3,4-oxadiazole (CID 71536209) is 2-(1-propan-2-ylindazol-3-yl)-5-(1-propan-2-ylpiperidin-4-yl)-1,3,4-oxadiazole.
What is the SMILES notation for 2-(1-propan-2-ylindazol-3-yl)-5-(1-propan-2-ylpiperidin-4-yl)-1,3,4-oxadiazole?
The canonical SMILES for 2-(1-propan-2-ylindazol-3-yl)-5-(1-propan-2-ylpiperidin-4-yl)-1,3,4-oxadiazole is CC(C)N1CCC(c2nnc(-c3nn(C(C)C)c4ccccc34)o2)CC1.
What is the InChIKey of 2-(1-propan-2-ylindazol-3-yl)-5-(1-propan-2-ylpiperidin-4-yl)-1,3,4-oxadiazole?
The InChIKey is HUYJRMFAFYNTRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27N5O/c1-13(2)24-11-9-15(10-12-24)19-21-22-20(26-19)18-16-7-5-6-8-17(16)25(23-18)14(3)4/h5-8,13-15H,9-12H2,1-4H3.
What are the key properties of 2-(1-propan-2-ylindazol-3-yl)-5-(1-propan-2-ylpiperidin-4-yl)-1,3,4-oxadiazole?
2-(1-propan-2-ylindazol-3-yl)-5-(1-propan-2-ylpiperidin-4-yl)-1,3,4-oxadiazole has a molecular weight of 353.47 g/mol, XLogP of 4.26, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-propan-2-ylindazol-3-yl)-5-(1-propan-2-ylpiperidin-4-yl)-1,3,4-oxadiazole is sourced from PubChem (CID 71536209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).