1-[4-methyl-2-(2-methylpropyl)pyrimidin-5-yl]ethanamine

C11H19N3 — CID 62770485

IUPAC1-[4-methyl-2-(2-methylpropyl)pyrimidin-5-yl]ethanamine
SMILESCc1nc(CC(C)C)ncc1C(C)N
InChIInChI=1S/C11H19N3/c1-7(2)5-11-13-6-10(8(3)12)9(4)14-11/h6-8H,5,12H2,1-4H3
InChIKeyGXFLABSTIKMFKX-UHFFFAOYSA-N
MW193.29 g/mol
LogP2.00
Rot. Bonds3

About 1-[4-methyl-2-(2-methylpropyl)pyrimidin-5-yl]ethanamine

1-[4-methyl-2-(2-methylpropyl)pyrimidin-5-yl]ethanamine (PubChem CID 62770485) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is 1-[4-methyl-2-(2-methylpropyl)pyrimidin-5-yl]ethanamine.

Molecular Properties

Compound Name1-[4-methyl-2-(2-methylpropyl)pyrimidin-5-yl]ethanamine
PubChem CID62770485
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC Name1-[4-methyl-2-(2-methylpropyl)pyrimidin-5-yl]ethanamine
SMILESCc1nc(CC(C)C)ncc1C(C)N
InChIInChI=1S/C11H19N3/c1-7(2)5-11-13-6-10(8(3)12)9(4)14-11/h6-8H,5,12H2,1-4H3
InChIKeyGXFLABSTIKMFKX-UHFFFAOYSA-N
XLogP2.00
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[4-methyl-2-(2-methylpropyl)pyrimidin-5-yl]ethanamine 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 1-[4-methyl-2-(2-methylpropyl)pyrimidin-5-yl]ethanamine?
The IUPAC name of 1-[4-methyl-2-(2-methylpropyl)pyrimidin-5-yl]ethanamine (CID 62770485) is 1-[4-methyl-2-(2-methylpropyl)pyrimidin-5-yl]ethanamine.
What is the SMILES notation for 1-[4-methyl-2-(2-methylpropyl)pyrimidin-5-yl]ethanamine?
The canonical SMILES for 1-[4-methyl-2-(2-methylpropyl)pyrimidin-5-yl]ethanamine is Cc1nc(CC(C)C)ncc1C(C)N.
What is the InChIKey of 1-[4-methyl-2-(2-methylpropyl)pyrimidin-5-yl]ethanamine?
The InChIKey is GXFLABSTIKMFKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1-7(2)5-11-13-6-10(8(3)12)9(4)14-11/h6-8H,5,12H2,1-4H3.
What are the key properties of 1-[4-methyl-2-(2-methylpropyl)pyrimidin-5-yl]ethanamine?
1-[4-methyl-2-(2-methylpropyl)pyrimidin-5-yl]ethanamine has a molecular weight of 193.29 g/mol, XLogP of 2.00, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-methyl-2-(2-methylpropyl)pyrimidin-5-yl]ethanamine is sourced from PubChem (CID 62770485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).