2-pyridin-2-yl-6-pyridin-3-yl-N-(pyridin-2-ylmethyl)pyrimidin-4-amine

C20H16N6 — CID 69182655

IUPAC2-pyridin-2-yl-6-pyridin-3-yl-N-(pyridin-2-ylmethyl)pyrimidin-4-amine
SMILESc1ccc(CNc2cc(-c3cccnc3)nc(-c3ccccn3)n2)nc1
InChIInChI=1S/C20H16N6/c1-3-10-22-16(7-1)14-24-19-12-18(15-6-5-9-21-13-15)25-20(26-19)17-8-2-4-11-23-17/h1-13H,14H2,(H,24,25,26)
InChIKeyMXBXCBKWOIYMQK-UHFFFAOYSA-N
MW340.39 g/mol
LogP3.61
Rot. Bonds5

About 2-pyridin-2-yl-6-pyridin-3-yl-N-(pyridin-2-ylmethyl)pyrimidin-4-amine

2-pyridin-2-yl-6-pyridin-3-yl-N-(pyridin-2-ylmethyl)pyrimidin-4-amine (PubChem CID 69182655) has the molecular formula C20H16N6 and a molecular weight of 340.39 g/mol. Its IUPAC name is 2-pyridin-2-yl-6-pyridin-3-yl-N-(pyridin-2-ylmethyl)pyrimidin-4-amine.

Molecular Properties

Compound Name2-pyridin-2-yl-6-pyridin-3-yl-N-(pyridin-2-ylmethyl)pyrimidin-4-amine
PubChem CID69182655
Molecular FormulaC20H16N6
Molecular Weight340.39 g/mol
Exact Mass340.14
IUPAC Name2-pyridin-2-yl-6-pyridin-3-yl-N-(pyridin-2-ylmethyl)pyrimidin-4-amine
SMILESc1ccc(CNc2cc(-c3cccnc3)nc(-c3ccccn3)n2)nc1
InChIInChI=1S/C20H16N6/c1-3-10-22-16(7-1)14-24-19-12-18(15-6-5-9-21-13-15)25-20(26-19)17-8-2-4-11-23-17/h1-13H,14H2,(H,24,25,26)
InChIKeyMXBXCBKWOIYMQK-UHFFFAOYSA-N
XLogP3.61
TPSA76.48 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.39
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(furan-2-ylmethyl)-2-pyridin-2-yl-6-pyridin-3-ylpyrimidin-4-amine
CID 4126935
2,6-diphenyl-N-(pyridin-2-ylmethyl)pyrimidin-4-amine
CID 59340687
2-[(2-pyridin-2-yl-6-pyridin-3-ylpyrimidin-4-yl)amino]butan-1-ol
CID 69184039
N-[[3-(aminomethyl)cyclohexyl]methyl]-2-pyridin-2-yl-6-pyridin-3-ylpyrimidin-4-amine
CID 69183338
trans-(1S,2S)-2-[(2-pyridin-2-yl-6-pyridin-3-ylpyrimidin-4-yl)amino]cyclohexan-1-ol
CID 69183255
N-[2-(6-fluoro-1H-indol-3-yl)ethyl]-2-pyridin-2-yl-6-pyridin-3-ylpyrimidin-4-amine
CID 24862955
N-(furan-2-ylmethyl)-6-phenyl-2-pyridin-2-ylpyrimidin-4-amine
CID 3314360
2-N-(3,5-dimethylphenyl)-6-phenyl-4-N-(pyridin-2-ylmethyl)pyrimidine-2,4-diamine
CID 112937130
2-pyridin-3-ylpyridine;dihydrochloride
CID 67024611
phenyl-[3-pyridin-3-yl-5-(pyridin-2-ylmethylamino)-1,2,4-triazol-1-yl]methanone
CID 67450762
3-[(2,6-dipyridin-3-ylpyrimidin-4-yl)amino]propan-1-ol
CID 3479964
3-[(2-pyridin-2-yl-6-pyridin-4-ylpyrimidin-4-yl)amino]propan-1-ol
CID 5069912

Frequently Asked Questions

What is the IUPAC name of 2-pyridin-2-yl-6-pyridin-3-yl-N-(pyridin-2-ylmethyl)pyrimidin-4-amine?
The IUPAC name of 2-pyridin-2-yl-6-pyridin-3-yl-N-(pyridin-2-ylmethyl)pyrimidin-4-amine (CID 69182655) is 2-pyridin-2-yl-6-pyridin-3-yl-N-(pyridin-2-ylmethyl)pyrimidin-4-amine.
What is the SMILES notation for 2-pyridin-2-yl-6-pyridin-3-yl-N-(pyridin-2-ylmethyl)pyrimidin-4-amine?
The canonical SMILES for 2-pyridin-2-yl-6-pyridin-3-yl-N-(pyridin-2-ylmethyl)pyrimidin-4-amine is c1ccc(CNc2cc(-c3cccnc3)nc(-c3ccccn3)n2)nc1.
What is the InChIKey of 2-pyridin-2-yl-6-pyridin-3-yl-N-(pyridin-2-ylmethyl)pyrimidin-4-amine?
The InChIKey is MXBXCBKWOIYMQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N6/c1-3-10-22-16(7-1)14-24-19-12-18(15-6-5-9-21-13-15)25-20(26-19)17-8-2-4-11-23-17/h1-13H,14H2,(H,24,25,26).
What are the key properties of 2-pyridin-2-yl-6-pyridin-3-yl-N-(pyridin-2-ylmethyl)pyrimidin-4-amine?
2-pyridin-2-yl-6-pyridin-3-yl-N-(pyridin-2-ylmethyl)pyrimidin-4-amine has a molecular weight of 340.39 g/mol, XLogP of 3.61, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyridin-2-yl-6-pyridin-3-yl-N-(pyridin-2-ylmethyl)pyrimidin-4-amine is sourced from PubChem (CID 69182655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).