6-(2-cyclobutylphenyl)-2-(methoxymethyl)pyrimidin-4-amine

C16H19N3O — CID 114607055

IUPAC6-(2-cyclobutylphenyl)-2-(methoxymethyl)pyrimidin-4-amine
SMILESCOCc1nc(N)cc(-c2ccccc2C2CCC2)n1
InChIInChI=1S/C16H19N3O/c1-20-10-16-18-14(9-15(17)19-16)13-8-3-2-7-12(13)11-5-4-6-11/h2-3,7-9,11H,4-6,10H2,1H3,(H2,17,18,19)
InChIKeyXGQRLLIZKPXGCE-UHFFFAOYSA-N
MW269.35 g/mol
LogP3.14
Rot. Bonds4

About 6-(2-cyclobutylphenyl)-2-(methoxymethyl)pyrimidin-4-amine

6-(2-cyclobutylphenyl)-2-(methoxymethyl)pyrimidin-4-amine (PubChem CID 114607055) has the molecular formula C16H19N3O and a molecular weight of 269.35 g/mol. Its IUPAC name is 6-(2-cyclobutylphenyl)-2-(methoxymethyl)pyrimidin-4-amine.

Molecular Properties

Compound Name6-(2-cyclobutylphenyl)-2-(methoxymethyl)pyrimidin-4-amine
PubChem CID114607055
Molecular FormulaC16H19N3O
Molecular Weight269.35 g/mol
Exact Mass269.15
IUPAC Name6-(2-cyclobutylphenyl)-2-(methoxymethyl)pyrimidin-4-amine
SMILESCOCc1nc(N)cc(-c2ccccc2C2CCC2)n1
InChIInChI=1S/C16H19N3O/c1-20-10-16-18-14(9-15(17)19-16)13-8-3-2-7-12(13)11-5-4-6-11/h2-3,7-9,11H,4-6,10H2,1H3,(H2,17,18,19)
InChIKeyXGQRLLIZKPXGCE-UHFFFAOYSA-N
XLogP3.14
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.35
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 6-(2-cyclobutylphenyl)-2-(methoxymethyl)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-(2-cyclobutylphenyl)-2-(methoxymethyl)pyrimidin-4-amine?
The IUPAC name of 6-(2-cyclobutylphenyl)-2-(methoxymethyl)pyrimidin-4-amine (CID 114607055) is 6-(2-cyclobutylphenyl)-2-(methoxymethyl)pyrimidin-4-amine.
What is the SMILES notation for 6-(2-cyclobutylphenyl)-2-(methoxymethyl)pyrimidin-4-amine?
The canonical SMILES for 6-(2-cyclobutylphenyl)-2-(methoxymethyl)pyrimidin-4-amine is COCc1nc(N)cc(-c2ccccc2C2CCC2)n1.
What is the InChIKey of 6-(2-cyclobutylphenyl)-2-(methoxymethyl)pyrimidin-4-amine?
The InChIKey is XGQRLLIZKPXGCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O/c1-20-10-16-18-14(9-15(17)19-16)13-8-3-2-7-12(13)11-5-4-6-11/h2-3,7-9,11H,4-6,10H2,1H3,(H2,17,18,19).
What are the key properties of 6-(2-cyclobutylphenyl)-2-(methoxymethyl)pyrimidin-4-amine?
6-(2-cyclobutylphenyl)-2-(methoxymethyl)pyrimidin-4-amine has a molecular weight of 269.35 g/mol, XLogP of 3.14, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-cyclobutylphenyl)-2-(methoxymethyl)pyrimidin-4-amine is sourced from PubChem (CID 114607055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).