3-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-5-(1H-indol-5-yl)pyridin-2-amine

C18H15N5O — CID 77106960

IUPAC3-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-5-(1H-indol-5-yl)pyridin-2-amine
SMILESNc1ncc(-c2ccc3[nH]ccc3c2)cc1-c1nnc(C2CC2)o1
InChIInChI=1S/C18H15N5O/c19-16-14(18-23-22-17(24-18)10-1-2-10)8-13(9-21-16)11-3-4-15-12(7-11)5-6-20-15/h3-10,20H,1-2H2,(H2,19,21)
InChIKeyOYEFMLFXAJEYCF-UHFFFAOYSA-N
MW317.35 g/mol
LogP3.74
Rot. Bonds3

About 3-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-5-(1H-indol-5-yl)pyridin-2-amine

3-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-5-(1H-indol-5-yl)pyridin-2-amine (PubChem CID 77106960) has the molecular formula C18H15N5O and a molecular weight of 317.35 g/mol. Its IUPAC name is 3-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-5-(1H-indol-5-yl)pyridin-2-amine.

Molecular Properties

Compound Name3-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-5-(1H-indol-5-yl)pyridin-2-amine
PubChem CID77106960
Molecular FormulaC18H15N5O
Molecular Weight317.35 g/mol
Exact Mass317.13
IUPAC Name3-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-5-(1H-indol-5-yl)pyridin-2-amine
SMILESNc1ncc(-c2ccc3[nH]ccc3c2)cc1-c1nnc(C2CC2)o1
InChIInChI=1S/C18H15N5O/c19-16-14(18-23-22-17(24-18)10-1-2-10)8-13(9-21-16)11-3-4-15-12(7-11)5-6-20-15/h3-10,20H,1-2H2,(H2,19,21)
InChIKeyOYEFMLFXAJEYCF-UHFFFAOYSA-N
XLogP3.74
TPSA93.62 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.35
LogP ≤ 53.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-5-(1H-indol-5-yl)pyridin-2-amine?
The IUPAC name of 3-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-5-(1H-indol-5-yl)pyridin-2-amine (CID 77106960) is 3-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-5-(1H-indol-5-yl)pyridin-2-amine.
What is the SMILES notation for 3-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-5-(1H-indol-5-yl)pyridin-2-amine?
The canonical SMILES for 3-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-5-(1H-indol-5-yl)pyridin-2-amine is Nc1ncc(-c2ccc3[nH]ccc3c2)cc1-c1nnc(C2CC2)o1.
What is the InChIKey of 3-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-5-(1H-indol-5-yl)pyridin-2-amine?
The InChIKey is OYEFMLFXAJEYCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N5O/c19-16-14(18-23-22-17(24-18)10-1-2-10)8-13(9-21-16)11-3-4-15-12(7-11)5-6-20-15/h3-10,20H,1-2H2,(H2,19,21).
What are the key properties of 3-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-5-(1H-indol-5-yl)pyridin-2-amine?
3-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-5-(1H-indol-5-yl)pyridin-2-amine has a molecular weight of 317.35 g/mol, XLogP of 3.74, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-cyclopropyl-1,3,4-oxadiazol-2-yl)-5-(1H-indol-5-yl)pyridin-2-amine is sourced from PubChem (CID 77106960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).