5-(1-methyl-2,3-dihydroindol-5-yl)-3-(5-piperidin-4-yl-1,3,4-oxadiazol-2-yl)pyridin-2-amine

C21H24N6O — CID 77105956

IUPAC5-(1-methyl-2,3-dihydroindol-5-yl)-3-(5-piperidin-4-yl-1,3,4-oxadiazol-2-yl)pyridin-2-amine
SMILESCN1CCc2cc(-c3cnc(N)c(-c4nnc(C5CCNCC5)o4)c3)ccc21
InChIInChI=1S/C21H24N6O/c1-27-9-6-15-10-14(2-3-18(15)27)16-11-17(19(22)24-12-16)21-26-25-20(28-21)13-4-7-23-8-5-13/h2-3,10-13,23H,4-9H2,1H3,(H2,22,24)
InChIKeyKBDRJATVSJLQHO-UHFFFAOYSA-N
MW376.46 g/mol
LogP2.84
Rot. Bonds3

About 5-(1-methyl-2,3-dihydroindol-5-yl)-3-(5-piperidin-4-yl-1,3,4-oxadiazol-2-yl)pyridin-2-amine

5-(1-methyl-2,3-dihydroindol-5-yl)-3-(5-piperidin-4-yl-1,3,4-oxadiazol-2-yl)pyridin-2-amine (PubChem CID 77105956) has the molecular formula C21H24N6O and a molecular weight of 376.46 g/mol. Its IUPAC name is 5-(1-methyl-2,3-dihydroindol-5-yl)-3-(5-piperidin-4-yl-1,3,4-oxadiazol-2-yl)pyridin-2-amine.

Molecular Properties

Compound Name5-(1-methyl-2,3-dihydroindol-5-yl)-3-(5-piperidin-4-yl-1,3,4-oxadiazol-2-yl)pyridin-2-amine
PubChem CID77105956
Molecular FormulaC21H24N6O
Molecular Weight376.46 g/mol
Exact Mass376.20
IUPAC Name5-(1-methyl-2,3-dihydroindol-5-yl)-3-(5-piperidin-4-yl-1,3,4-oxadiazol-2-yl)pyridin-2-amine
SMILESCN1CCc2cc(-c3cnc(N)c(-c4nnc(C5CCNCC5)o4)c3)ccc21
InChIInChI=1S/C21H24N6O/c1-27-9-6-15-10-14(2-3-18(15)27)16-11-17(19(22)24-12-16)21-26-25-20(28-21)13-4-7-23-8-5-13/h2-3,10-13,23H,4-9H2,1H3,(H2,22,24)
InChIKeyKBDRJATVSJLQHO-UHFFFAOYSA-N
XLogP2.84
TPSA93.10 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.46
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 5-(1-methyl-2,3-dihydroindol-5-yl)-3-(5-piperidin-4-yl-1,3,4-oxadiazol-2-yl)pyridin-2-amine?
The IUPAC name of 5-(1-methyl-2,3-dihydroindol-5-yl)-3-(5-piperidin-4-yl-1,3,4-oxadiazol-2-yl)pyridin-2-amine (CID 77105956) is 5-(1-methyl-2,3-dihydroindol-5-yl)-3-(5-piperidin-4-yl-1,3,4-oxadiazol-2-yl)pyridin-2-amine.
What is the SMILES notation for 5-(1-methyl-2,3-dihydroindol-5-yl)-3-(5-piperidin-4-yl-1,3,4-oxadiazol-2-yl)pyridin-2-amine?
The canonical SMILES for 5-(1-methyl-2,3-dihydroindol-5-yl)-3-(5-piperidin-4-yl-1,3,4-oxadiazol-2-yl)pyridin-2-amine is CN1CCc2cc(-c3cnc(N)c(-c4nnc(C5CCNCC5)o4)c3)ccc21.
What is the InChIKey of 5-(1-methyl-2,3-dihydroindol-5-yl)-3-(5-piperidin-4-yl-1,3,4-oxadiazol-2-yl)pyridin-2-amine?
The InChIKey is KBDRJATVSJLQHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N6O/c1-27-9-6-15-10-14(2-3-18(15)27)16-11-17(19(22)24-12-16)21-26-25-20(28-21)13-4-7-23-8-5-13/h2-3,10-13,23H,4-9H2,1H3,(H2,22,24).
What are the key properties of 5-(1-methyl-2,3-dihydroindol-5-yl)-3-(5-piperidin-4-yl-1,3,4-oxadiazol-2-yl)pyridin-2-amine?
5-(1-methyl-2,3-dihydroindol-5-yl)-3-(5-piperidin-4-yl-1,3,4-oxadiazol-2-yl)pyridin-2-amine has a molecular weight of 376.46 g/mol, XLogP of 2.84, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-methyl-2,3-dihydroindol-5-yl)-3-(5-piperidin-4-yl-1,3,4-oxadiazol-2-yl)pyridin-2-amine is sourced from PubChem (CID 77105956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).