6-ethyl-2-methyl-N-(2-phenylethyl)pyrimidin-4-amine

C15H19N3 — CID 65418225

IUPAC6-ethyl-2-methyl-N-(2-phenylethyl)pyrimidin-4-amine
SMILESCCc1cc(NCCc2ccccc2)nc(C)n1
InChIInChI=1S/C15H19N3/c1-3-14-11-15(18-12(2)17-14)16-10-9-13-7-5-4-6-8-13/h4-8,11H,3,9-10H2,1-2H3,(H,16,17,18)
InChIKeyCSABRTJBJBVOFA-UHFFFAOYSA-N
MW241.34 g/mol
LogP3.00
Rot. Bonds5

About 6-ethyl-2-methyl-N-(2-phenylethyl)pyrimidin-4-amine

6-ethyl-2-methyl-N-(2-phenylethyl)pyrimidin-4-amine (PubChem CID 65418225) has the molecular formula C15H19N3 and a molecular weight of 241.34 g/mol. Its IUPAC name is 6-ethyl-2-methyl-N-(2-phenylethyl)pyrimidin-4-amine.

Molecular Properties

Compound Name6-ethyl-2-methyl-N-(2-phenylethyl)pyrimidin-4-amine
PubChem CID65418225
Molecular FormulaC15H19N3
Molecular Weight241.34 g/mol
Exact Mass241.16
IUPAC Name6-ethyl-2-methyl-N-(2-phenylethyl)pyrimidin-4-amine
SMILESCCc1cc(NCCc2ccccc2)nc(C)n1
InChIInChI=1S/C15H19N3/c1-3-14-11-15(18-12(2)17-14)16-10-9-13-7-5-4-6-8-13/h4-8,11H,3,9-10H2,1-2H3,(H,16,17,18)
InChIKeyCSABRTJBJBVOFA-UHFFFAOYSA-N
XLogP3.00
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.34
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-ethyl-2-methyl-N-(2-phenylethyl)pyrimidin-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 6-ethyl-2-methyl-N-(2-phenylethyl)pyrimidin-4-amine?
The IUPAC name of 6-ethyl-2-methyl-N-(2-phenylethyl)pyrimidin-4-amine (CID 65418225) is 6-ethyl-2-methyl-N-(2-phenylethyl)pyrimidin-4-amine.
What is the SMILES notation for 6-ethyl-2-methyl-N-(2-phenylethyl)pyrimidin-4-amine?
The canonical SMILES for 6-ethyl-2-methyl-N-(2-phenylethyl)pyrimidin-4-amine is CCc1cc(NCCc2ccccc2)nc(C)n1.
What is the InChIKey of 6-ethyl-2-methyl-N-(2-phenylethyl)pyrimidin-4-amine?
The InChIKey is CSABRTJBJBVOFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3/c1-3-14-11-15(18-12(2)17-14)16-10-9-13-7-5-4-6-8-13/h4-8,11H,3,9-10H2,1-2H3,(H,16,17,18).
What are the key properties of 6-ethyl-2-methyl-N-(2-phenylethyl)pyrimidin-4-amine?
6-ethyl-2-methyl-N-(2-phenylethyl)pyrimidin-4-amine has a molecular weight of 241.34 g/mol, XLogP of 3.00, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-2-methyl-N-(2-phenylethyl)pyrimidin-4-amine is sourced from PubChem (CID 65418225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).