2-ethyl-6-quinolin-5-ylpyrimidin-4-amine

C15H14N4 — CID 81222143

IUPAC2-ethyl-6-quinolin-5-ylpyrimidin-4-amine
SMILESCCc1nc(N)cc(-c2cccc3ncccc23)n1
InChIInChI=1S/C15H14N4/c1-2-15-18-13(9-14(16)19-15)11-5-3-7-12-10(11)6-4-8-17-12/h3-9H,2H2,1H3,(H2,16,18,19)
InChIKeyPTFMHHHOHFVKSX-UHFFFAOYSA-N
MW250.30 g/mol
LogP2.84
Rot. Bonds2

About 2-ethyl-6-quinolin-5-ylpyrimidin-4-amine

2-ethyl-6-quinolin-5-ylpyrimidin-4-amine (PubChem CID 81222143) has the molecular formula C15H14N4 and a molecular weight of 250.30 g/mol. Its IUPAC name is 2-ethyl-6-quinolin-5-ylpyrimidin-4-amine.

Molecular Properties

Compound Name2-ethyl-6-quinolin-5-ylpyrimidin-4-amine
PubChem CID81222143
Molecular FormulaC15H14N4
Molecular Weight250.30 g/mol
Exact Mass250.12
IUPAC Name2-ethyl-6-quinolin-5-ylpyrimidin-4-amine
SMILESCCc1nc(N)cc(-c2cccc3ncccc23)n1
InChIInChI=1S/C15H14N4/c1-2-15-18-13(9-14(16)19-15)11-5-3-7-12-10(11)6-4-8-17-12/h3-9H,2H2,1H3,(H2,16,18,19)
InChIKeyPTFMHHHOHFVKSX-UHFFFAOYSA-N
XLogP2.84
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-ethyl-6-quinolin-5-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 2-ethyl-6-quinolin-5-ylpyrimidin-4-amine?
The IUPAC name of 2-ethyl-6-quinolin-5-ylpyrimidin-4-amine (CID 81222143) is 2-ethyl-6-quinolin-5-ylpyrimidin-4-amine.
What is the SMILES notation for 2-ethyl-6-quinolin-5-ylpyrimidin-4-amine?
The canonical SMILES for 2-ethyl-6-quinolin-5-ylpyrimidin-4-amine is CCc1nc(N)cc(-c2cccc3ncccc23)n1.
What is the InChIKey of 2-ethyl-6-quinolin-5-ylpyrimidin-4-amine?
The InChIKey is PTFMHHHOHFVKSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4/c1-2-15-18-13(9-14(16)19-15)11-5-3-7-12-10(11)6-4-8-17-12/h3-9H,2H2,1H3,(H2,16,18,19).
What are the key properties of 2-ethyl-6-quinolin-5-ylpyrimidin-4-amine?
2-ethyl-6-quinolin-5-ylpyrimidin-4-amine has a molecular weight of 250.30 g/mol, XLogP of 2.84, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-6-quinolin-5-ylpyrimidin-4-amine is sourced from PubChem (CID 81222143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).