1-(4,6-dimethylpyrimidin-2-yl)-3-pyridin-3-ylpyrazol-4-amine

C14H14N6 — CID 83216257

IUPAC1-(4,6-dimethylpyrimidin-2-yl)-3-pyridin-3-ylpyrazol-4-amine
SMILESCc1cc(C)nc(-n2cc(N)c(-c3cccnc3)n2)n1
InChIInChI=1S/C14H14N6/c1-9-6-10(2)18-14(17-9)20-8-12(15)13(19-20)11-4-3-5-16-7-11/h3-8H,15H2,1-2H3
InChIKeyALJJGFZYVOGLNG-UHFFFAOYSA-N
MW266.31 g/mol
LogP1.92
Rot. Bonds2

About 1-(4,6-dimethylpyrimidin-2-yl)-3-pyridin-3-ylpyrazol-4-amine

1-(4,6-dimethylpyrimidin-2-yl)-3-pyridin-3-ylpyrazol-4-amine (PubChem CID 83216257) has the molecular formula C14H14N6 and a molecular weight of 266.31 g/mol. Its IUPAC name is 1-(4,6-dimethylpyrimidin-2-yl)-3-pyridin-3-ylpyrazol-4-amine.

Molecular Properties

Compound Name1-(4,6-dimethylpyrimidin-2-yl)-3-pyridin-3-ylpyrazol-4-amine
PubChem CID83216257
Molecular FormulaC14H14N6
Molecular Weight266.31 g/mol
Exact Mass266.13
IUPAC Name1-(4,6-dimethylpyrimidin-2-yl)-3-pyridin-3-ylpyrazol-4-amine
SMILESCc1cc(C)nc(-n2cc(N)c(-c3cccnc3)n2)n1
InChIInChI=1S/C14H14N6/c1-9-6-10(2)18-14(17-9)20-8-12(15)13(19-20)11-4-3-5-16-7-11/h3-8H,15H2,1-2H3
InChIKeyALJJGFZYVOGLNG-UHFFFAOYSA-N
XLogP1.92
TPSA82.51 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.31
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-(4,6-dimethylpyrimidin-2-yl)-3-pyridin-3-ylpyrazol-4-amine?
The IUPAC name of 1-(4,6-dimethylpyrimidin-2-yl)-3-pyridin-3-ylpyrazol-4-amine (CID 83216257) is 1-(4,6-dimethylpyrimidin-2-yl)-3-pyridin-3-ylpyrazol-4-amine.
What is the SMILES notation for 1-(4,6-dimethylpyrimidin-2-yl)-3-pyridin-3-ylpyrazol-4-amine?
The canonical SMILES for 1-(4,6-dimethylpyrimidin-2-yl)-3-pyridin-3-ylpyrazol-4-amine is Cc1cc(C)nc(-n2cc(N)c(-c3cccnc3)n2)n1.
What is the InChIKey of 1-(4,6-dimethylpyrimidin-2-yl)-3-pyridin-3-ylpyrazol-4-amine?
The InChIKey is ALJJGFZYVOGLNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N6/c1-9-6-10(2)18-14(17-9)20-8-12(15)13(19-20)11-4-3-5-16-7-11/h3-8H,15H2,1-2H3.
What are the key properties of 1-(4,6-dimethylpyrimidin-2-yl)-3-pyridin-3-ylpyrazol-4-amine?
1-(4,6-dimethylpyrimidin-2-yl)-3-pyridin-3-ylpyrazol-4-amine has a molecular weight of 266.31 g/mol, XLogP of 1.92, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4,6-dimethylpyrimidin-2-yl)-3-pyridin-3-ylpyrazol-4-amine is sourced from PubChem (CID 83216257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).