5-ethyl-2-pyridin-4-ylpyrimidin-4-amine

C11H12N4 — CID 21404719

IUPAC5-ethyl-2-pyridin-4-ylpyrimidin-4-amine
SMILESCCc1cnc(-c2ccncc2)nc1N
InChIInChI=1S/C11H12N4/c1-2-8-7-14-11(15-10(8)12)9-3-5-13-6-4-9/h3-7H,2H2,1H3,(H2,12,14,15)
InChIKeyAVIGQIBKXVCDKC-UHFFFAOYSA-N
MW200.25 g/mol
LogP1.68
Rot. Bonds2

About 5-ethyl-2-pyridin-4-ylpyrimidin-4-amine

5-ethyl-2-pyridin-4-ylpyrimidin-4-amine (PubChem CID 21404719) has the molecular formula C11H12N4 and a molecular weight of 200.25 g/mol. Its IUPAC name is 5-ethyl-2-pyridin-4-ylpyrimidin-4-amine.

Molecular Properties

Compound Name5-ethyl-2-pyridin-4-ylpyrimidin-4-amine
PubChem CID21404719
Molecular FormulaC11H12N4
Molecular Weight200.25 g/mol
Exact Mass200.11
IUPAC Name5-ethyl-2-pyridin-4-ylpyrimidin-4-amine
SMILESCCc1cnc(-c2ccncc2)nc1N
InChIInChI=1S/C11H12N4/c1-2-8-7-14-11(15-10(8)12)9-3-5-13-6-4-9/h3-7H,2H2,1H3,(H2,12,14,15)
InChIKeyAVIGQIBKXVCDKC-UHFFFAOYSA-N
XLogP1.68
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.25
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-ethyl-2-pyridin-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-2-pyridin-4-ylpyrimidin-4-amine?
The IUPAC name of 5-ethyl-2-pyridin-4-ylpyrimidin-4-amine (CID 21404719) is 5-ethyl-2-pyridin-4-ylpyrimidin-4-amine.
What is the SMILES notation for 5-ethyl-2-pyridin-4-ylpyrimidin-4-amine?
The canonical SMILES for 5-ethyl-2-pyridin-4-ylpyrimidin-4-amine is CCc1cnc(-c2ccncc2)nc1N.
What is the InChIKey of 5-ethyl-2-pyridin-4-ylpyrimidin-4-amine?
The InChIKey is AVIGQIBKXVCDKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N4/c1-2-8-7-14-11(15-10(8)12)9-3-5-13-6-4-9/h3-7H,2H2,1H3,(H2,12,14,15).
What are the key properties of 5-ethyl-2-pyridin-4-ylpyrimidin-4-amine?
5-ethyl-2-pyridin-4-ylpyrimidin-4-amine has a molecular weight of 200.25 g/mol, XLogP of 1.68, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-2-pyridin-4-ylpyrimidin-4-amine is sourced from PubChem (CID 21404719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).