6-[2-(6-amino-2-pyridinyl)-1,2-dipyridin-3-ylethyl]pyridin-2-amine

C22H20N6 — CID 11639243

IUPAC6-[2-(6-amino-2-pyridinyl)-1,2-dipyridin-3-ylethyl]pyridin-2-amine
SMILESNc1cccc(C(c2cccnc2)C(c2cccnc2)c2cccc(N)n2)n1
InChIInChI=1S/C22H20N6/c23-19-9-1-7-17(27-19)21(15-5-3-11-25-13-15)22(16-6-4-12-26-14-16)18-8-2-10-20(24)28-18/h1-14,21-22H,(H2,23,27)(H2,24,28)
InChIKeyHSDIAUYXPXGROI-UHFFFAOYSA-N
MW368.44 g/mol
LogP3.39
Rot. Bonds5

About 6-[2-(6-amino-2-pyridinyl)-1,2-dipyridin-3-ylethyl]pyridin-2-amine

6-[2-(6-amino-2-pyridinyl)-1,2-dipyridin-3-ylethyl]pyridin-2-amine (PubChem CID 11639243) has the molecular formula C22H20N6 and a molecular weight of 368.44 g/mol. Its IUPAC name is 6-[2-(6-amino-2-pyridinyl)-1,2-dipyridin-3-ylethyl]pyridin-2-amine.

Molecular Properties

Compound Name6-[2-(6-amino-2-pyridinyl)-1,2-dipyridin-3-ylethyl]pyridin-2-amine
PubChem CID11639243
Molecular FormulaC22H20N6
Molecular Weight368.44 g/mol
Exact Mass368.17
IUPAC Name6-[2-(6-amino-2-pyridinyl)-1,2-dipyridin-3-ylethyl]pyridin-2-amine
SMILESNc1cccc(C(c2cccnc2)C(c2cccnc2)c2cccc(N)n2)n1
InChIInChI=1S/C22H20N6/c23-19-9-1-7-17(27-19)21(15-5-3-11-25-13-15)22(16-6-4-12-26-14-16)18-8-2-10-20(24)28-18/h1-14,21-22H,(H2,23,27)(H2,24,28)
InChIKeyHSDIAUYXPXGROI-UHFFFAOYSA-N
XLogP3.39
TPSA103.60 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.44
LogP ≤ 53.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-[2-(6-amino-2-pyridinyl)-1,2-dipyridin-3-ylethyl]pyridin-2-amine?
The IUPAC name of 6-[2-(6-amino-2-pyridinyl)-1,2-dipyridin-3-ylethyl]pyridin-2-amine (CID 11639243) is 6-[2-(6-amino-2-pyridinyl)-1,2-dipyridin-3-ylethyl]pyridin-2-amine.
What is the SMILES notation for 6-[2-(6-amino-2-pyridinyl)-1,2-dipyridin-3-ylethyl]pyridin-2-amine?
The canonical SMILES for 6-[2-(6-amino-2-pyridinyl)-1,2-dipyridin-3-ylethyl]pyridin-2-amine is Nc1cccc(C(c2cccnc2)C(c2cccnc2)c2cccc(N)n2)n1.
What is the InChIKey of 6-[2-(6-amino-2-pyridinyl)-1,2-dipyridin-3-ylethyl]pyridin-2-amine?
The InChIKey is HSDIAUYXPXGROI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N6/c23-19-9-1-7-17(27-19)21(15-5-3-11-25-13-15)22(16-6-4-12-26-14-16)18-8-2-10-20(24)28-18/h1-14,21-22H,(H2,23,27)(H2,24,28).
What are the key properties of 6-[2-(6-amino-2-pyridinyl)-1,2-dipyridin-3-ylethyl]pyridin-2-amine?
6-[2-(6-amino-2-pyridinyl)-1,2-dipyridin-3-ylethyl]pyridin-2-amine has a molecular weight of 368.44 g/mol, XLogP of 3.39, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(6-amino-2-pyridinyl)-1,2-dipyridin-3-ylethyl]pyridin-2-amine is sourced from PubChem (CID 11639243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).