3-[1-(2-methylpropyl)indol-5-yl]pyridin-2-amine

C17H19N3 — CID 66749621

IUPAC3-[1-(2-methylpropyl)indol-5-yl]pyridin-2-amine
SMILESCC(C)Cn1ccc2cc(-c3cccnc3N)ccc21
InChIInChI=1S/C17H19N3/c1-12(2)11-20-9-7-14-10-13(5-6-16(14)20)15-4-3-8-19-17(15)18/h3-10,12H,11H2,1-2H3,(H2,18,19)
InChIKeyNQKONRYZCDBKQO-UHFFFAOYSA-N
MW265.36 g/mol
LogP3.94
Rot. Bonds3

About 3-[1-(2-methylpropyl)indol-5-yl]pyridin-2-amine

3-[1-(2-methylpropyl)indol-5-yl]pyridin-2-amine (PubChem CID 66749621) has the molecular formula C17H19N3 and a molecular weight of 265.36 g/mol. Its IUPAC name is 3-[1-(2-methylpropyl)indol-5-yl]pyridin-2-amine.

Molecular Properties

Compound Name3-[1-(2-methylpropyl)indol-5-yl]pyridin-2-amine
PubChem CID66749621
Molecular FormulaC17H19N3
Molecular Weight265.36 g/mol
Exact Mass265.16
IUPAC Name3-[1-(2-methylpropyl)indol-5-yl]pyridin-2-amine
SMILESCC(C)Cn1ccc2cc(-c3cccnc3N)ccc21
InChIInChI=1S/C17H19N3/c1-12(2)11-20-9-7-14-10-13(5-6-16(14)20)15-4-3-8-19-17(15)18/h3-10,12H,11H2,1-2H3,(H2,18,19)
InChIKeyNQKONRYZCDBKQO-UHFFFAOYSA-N
XLogP3.94
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 53.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-[1-(2-methylpropyl)indol-5-yl]pyridin-2-amine?
The IUPAC name of 3-[1-(2-methylpropyl)indol-5-yl]pyridin-2-amine (CID 66749621) is 3-[1-(2-methylpropyl)indol-5-yl]pyridin-2-amine.
What is the SMILES notation for 3-[1-(2-methylpropyl)indol-5-yl]pyridin-2-amine?
The canonical SMILES for 3-[1-(2-methylpropyl)indol-5-yl]pyridin-2-amine is CC(C)Cn1ccc2cc(-c3cccnc3N)ccc21.
What is the InChIKey of 3-[1-(2-methylpropyl)indol-5-yl]pyridin-2-amine?
The InChIKey is NQKONRYZCDBKQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3/c1-12(2)11-20-9-7-14-10-13(5-6-16(14)20)15-4-3-8-19-17(15)18/h3-10,12H,11H2,1-2H3,(H2,18,19).
What are the key properties of 3-[1-(2-methylpropyl)indol-5-yl]pyridin-2-amine?
3-[1-(2-methylpropyl)indol-5-yl]pyridin-2-amine has a molecular weight of 265.36 g/mol, XLogP of 3.94, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-(2-methylpropyl)indol-5-yl]pyridin-2-amine is sourced from PubChem (CID 66749621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).