3-(6-methoxy-2-propan-2-ylpyrimidin-4-yl)propan-1-amine

C11H19N3O — CID 83884578

IUPAC3-(6-methoxy-2-propan-2-ylpyrimidin-4-yl)propan-1-amine
SMILESCOc1cc(CCCN)nc(C(C)C)n1
InChIInChI=1S/C11H19N3O/c1-8(2)11-13-9(5-4-6-12)7-10(14-11)15-3/h7-8H,4-6,12H2,1-3H3
InChIKeyNHJLGUGMOQKCQA-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.50
Rot. Bonds5

About 3-(6-methoxy-2-propan-2-ylpyrimidin-4-yl)propan-1-amine

3-(6-methoxy-2-propan-2-ylpyrimidin-4-yl)propan-1-amine (PubChem CID 83884578) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is 3-(6-methoxy-2-propan-2-ylpyrimidin-4-yl)propan-1-amine.

Molecular Properties

Compound Name3-(6-methoxy-2-propan-2-ylpyrimidin-4-yl)propan-1-amine
PubChem CID83884578
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name3-(6-methoxy-2-propan-2-ylpyrimidin-4-yl)propan-1-amine
SMILESCOc1cc(CCCN)nc(C(C)C)n1
InChIInChI=1S/C11H19N3O/c1-8(2)11-13-9(5-4-6-12)7-10(14-11)15-3/h7-8H,4-6,12H2,1-3H3
InChIKeyNHJLGUGMOQKCQA-UHFFFAOYSA-N
XLogP1.50
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-(6-methoxy-2-propan-2-ylpyrimidin-4-yl)propan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(6-methoxy-2-propan-2-ylpyrimidin-4-yl)methanamine
CID 83851901
2-(6-methoxy-2-propan-2-ylpyrimidin-4-yl)acetaldehyde
CID 83878785
2-(6-bromo-2-propan-2-ylpyrimidin-4-yl)ethanamine
CID 83852748
4-(2-aminoethyl)-6-methoxypyrimidin-2-amine
CID 83851816
2-(2-ethyl-6-methoxypyrimidin-4-yl)ethanamine
CID 83851900
1-[4-[(2-fluorophenyl)methyl]-6-methoxypyrimidin-2-yl]ethanamine
CID 82666098
2-[6-methoxy-2-(trifluoromethyl)pyrimidin-4-yl]ethanamine
CID 83889810
3-(6-methoxy-2-methylpyrimidin-4-yl)-2-methylpropan-1-amine
CID 83847571
(2-bromo-6-methoxypyrimidin-4-yl)methanamine
CID 83852368
(2-cyclobutyl-6-methoxy-4-pyridinyl)methanamine
CID 105446432
6-(3-methoxypropoxy)-2-propan-2-ylpyrimidin-4-amine
CID 80965218
3-(4-propan-2-yl-2-pyridinyl)propan-1-amine
CID 115004203

Frequently Asked Questions

What is the IUPAC name of 3-(6-methoxy-2-propan-2-ylpyrimidin-4-yl)propan-1-amine?
The IUPAC name of 3-(6-methoxy-2-propan-2-ylpyrimidin-4-yl)propan-1-amine (CID 83884578) is 3-(6-methoxy-2-propan-2-ylpyrimidin-4-yl)propan-1-amine.
What is the SMILES notation for 3-(6-methoxy-2-propan-2-ylpyrimidin-4-yl)propan-1-amine?
The canonical SMILES for 3-(6-methoxy-2-propan-2-ylpyrimidin-4-yl)propan-1-amine is COc1cc(CCCN)nc(C(C)C)n1.
What is the InChIKey of 3-(6-methoxy-2-propan-2-ylpyrimidin-4-yl)propan-1-amine?
The InChIKey is NHJLGUGMOQKCQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-8(2)11-13-9(5-4-6-12)7-10(14-11)15-3/h7-8H,4-6,12H2,1-3H3.
What are the key properties of 3-(6-methoxy-2-propan-2-ylpyrimidin-4-yl)propan-1-amine?
3-(6-methoxy-2-propan-2-ylpyrimidin-4-yl)propan-1-amine has a molecular weight of 209.29 g/mol, XLogP of 1.50, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6-methoxy-2-propan-2-ylpyrimidin-4-yl)propan-1-amine is sourced from PubChem (CID 83884578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).