5-ethyl-6-methyl-2-pyrimidin-4-ylpyrimidin-4-amine

C11H13N5 — CID 63984854

IUPAC5-ethyl-6-methyl-2-pyrimidin-4-ylpyrimidin-4-amine
SMILESCCc1c(C)nc(-c2ccncn2)nc1N
InChIInChI=1S/C11H13N5/c1-3-8-7(2)15-11(16-10(8)12)9-4-5-13-6-14-9/h4-6H,3H2,1-2H3,(H2,12,15,16)
InChIKeyWZVLAPBKXDWZQV-UHFFFAOYSA-N
MW215.26 g/mol
LogP1.39
Rot. Bonds2

About 5-ethyl-6-methyl-2-pyrimidin-4-ylpyrimidin-4-amine

5-ethyl-6-methyl-2-pyrimidin-4-ylpyrimidin-4-amine (PubChem CID 63984854) has the molecular formula C11H13N5 and a molecular weight of 215.26 g/mol. Its IUPAC name is 5-ethyl-6-methyl-2-pyrimidin-4-ylpyrimidin-4-amine.

Molecular Properties

Compound Name5-ethyl-6-methyl-2-pyrimidin-4-ylpyrimidin-4-amine
PubChem CID63984854
Molecular FormulaC11H13N5
Molecular Weight215.26 g/mol
Exact Mass215.12
IUPAC Name5-ethyl-6-methyl-2-pyrimidin-4-ylpyrimidin-4-amine
SMILESCCc1c(C)nc(-c2ccncn2)nc1N
InChIInChI=1S/C11H13N5/c1-3-8-7(2)15-11(16-10(8)12)9-4-5-13-6-14-9/h4-6H,3H2,1-2H3,(H2,12,15,16)
InChIKeyWZVLAPBKXDWZQV-UHFFFAOYSA-N
XLogP1.39
TPSA77.58 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.26
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-ethyl-6-methyl-2-pyrimidin-4-ylpyrimidin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-6-methyl-2-pyrimidin-4-ylpyrimidin-4-amine?
The IUPAC name of 5-ethyl-6-methyl-2-pyrimidin-4-ylpyrimidin-4-amine (CID 63984854) is 5-ethyl-6-methyl-2-pyrimidin-4-ylpyrimidin-4-amine.
What is the SMILES notation for 5-ethyl-6-methyl-2-pyrimidin-4-ylpyrimidin-4-amine?
The canonical SMILES for 5-ethyl-6-methyl-2-pyrimidin-4-ylpyrimidin-4-amine is CCc1c(C)nc(-c2ccncn2)nc1N.
What is the InChIKey of 5-ethyl-6-methyl-2-pyrimidin-4-ylpyrimidin-4-amine?
The InChIKey is WZVLAPBKXDWZQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N5/c1-3-8-7(2)15-11(16-10(8)12)9-4-5-13-6-14-9/h4-6H,3H2,1-2H3,(H2,12,15,16).
What are the key properties of 5-ethyl-6-methyl-2-pyrimidin-4-ylpyrimidin-4-amine?
5-ethyl-6-methyl-2-pyrimidin-4-ylpyrimidin-4-amine has a molecular weight of 215.26 g/mol, XLogP of 1.39, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-6-methyl-2-pyrimidin-4-ylpyrimidin-4-amine is sourced from PubChem (CID 63984854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).