4-(aminomethyl)-N,N,6-trimethylpyrimidin-2-amine

C8H14N4 — CID 28904050

IUPAC4-(aminomethyl)-N,N,6-trimethylpyrimidin-2-amine
SMILESCc1cc(CN)nc(N(C)C)n1
InChIInChI=1S/C8H14N4/c1-6-4-7(5-9)11-8(10-6)12(2)3/h4H,5,9H2,1-3H3
InChIKeyQUTNNKVOFOZWEM-UHFFFAOYSA-N
MW166.23 g/mol
LogP0.31
Rot. Bonds2

About 4-(aminomethyl)-N,N,6-trimethylpyrimidin-2-amine

4-(aminomethyl)-N,N,6-trimethylpyrimidin-2-amine (PubChem CID 28904050) has the molecular formula C8H14N4 and a molecular weight of 166.23 g/mol. Its IUPAC name is 4-(aminomethyl)-N,N,6-trimethylpyrimidin-2-amine.

Molecular Properties

Compound Name4-(aminomethyl)-N,N,6-trimethylpyrimidin-2-amine
PubChem CID28904050
Molecular FormulaC8H14N4
Molecular Weight166.23 g/mol
Exact Mass166.12
IUPAC Name4-(aminomethyl)-N,N,6-trimethylpyrimidin-2-amine
SMILESCc1cc(CN)nc(N(C)C)n1
InChIInChI=1S/C8H14N4/c1-6-4-7(5-9)11-8(10-6)12(2)3/h4H,5,9H2,1-3H3
InChIKeyQUTNNKVOFOZWEM-UHFFFAOYSA-N
XLogP0.31
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.23
LogP ≤ 50.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-(aminomethyl)-N,N,6-trimethylpyrimidin-2-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 4-(aminomethyl)-N,N,6-trimethylpyrimidin-2-amine?
The IUPAC name of 4-(aminomethyl)-N,N,6-trimethylpyrimidin-2-amine (CID 28904050) is 4-(aminomethyl)-N,N,6-trimethylpyrimidin-2-amine.
What is the SMILES notation for 4-(aminomethyl)-N,N,6-trimethylpyrimidin-2-amine?
The canonical SMILES for 4-(aminomethyl)-N,N,6-trimethylpyrimidin-2-amine is Cc1cc(CN)nc(N(C)C)n1.
What is the InChIKey of 4-(aminomethyl)-N,N,6-trimethylpyrimidin-2-amine?
The InChIKey is QUTNNKVOFOZWEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N4/c1-6-4-7(5-9)11-8(10-6)12(2)3/h4H,5,9H2,1-3H3.
What are the key properties of 4-(aminomethyl)-N,N,6-trimethylpyrimidin-2-amine?
4-(aminomethyl)-N,N,6-trimethylpyrimidin-2-amine has a molecular weight of 166.23 g/mol, XLogP of 0.31, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(aminomethyl)-N,N,6-trimethylpyrimidin-2-amine is sourced from PubChem (CID 28904050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).