4-(2-methoxyphenyl)-2-methyl-6-pyrrolidin-1-ylpyrimidin-5-amine

C16H20N4O — CID 83286314

IUPAC4-(2-methoxyphenyl)-2-methyl-6-pyrrolidin-1-ylpyrimidin-5-amine
SMILESCOc1ccccc1-c1nc(C)nc(N2CCCC2)c1N
InChIInChI=1S/C16H20N4O/c1-11-18-15(12-7-3-4-8-13(12)21-2)14(17)16(19-11)20-9-5-6-10-20/h3-4,7-8H,5-6,9-10,17H2,1-2H3
InChIKeyQXZXZCZWWMPSFC-UHFFFAOYSA-N
MW284.36 g/mol
LogP2.64
Rot. Bonds3

About 4-(2-methoxyphenyl)-2-methyl-6-pyrrolidin-1-ylpyrimidin-5-amine

4-(2-methoxyphenyl)-2-methyl-6-pyrrolidin-1-ylpyrimidin-5-amine (PubChem CID 83286314) has the molecular formula C16H20N4O and a molecular weight of 284.36 g/mol. Its IUPAC name is 4-(2-methoxyphenyl)-2-methyl-6-pyrrolidin-1-ylpyrimidin-5-amine.

Molecular Properties

Compound Name4-(2-methoxyphenyl)-2-methyl-6-pyrrolidin-1-ylpyrimidin-5-amine
PubChem CID83286314
Molecular FormulaC16H20N4O
Molecular Weight284.36 g/mol
Exact Mass284.16
IUPAC Name4-(2-methoxyphenyl)-2-methyl-6-pyrrolidin-1-ylpyrimidin-5-amine
SMILESCOc1ccccc1-c1nc(C)nc(N2CCCC2)c1N
InChIInChI=1S/C16H20N4O/c1-11-18-15(12-7-3-4-8-13(12)21-2)14(17)16(19-11)20-9-5-6-10-20/h3-4,7-8H,5-6,9-10,17H2,1-2H3
InChIKeyQXZXZCZWWMPSFC-UHFFFAOYSA-N
XLogP2.64
TPSA64.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-(2-methoxyphenyl)-2-methyl-6-pyrrolidin-1-ylpyrimidin-5-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-(2-methoxyphenyl)-2-methyl-6-pyrrolidin-1-ylpyrimidin-5-amine?
The IUPAC name of 4-(2-methoxyphenyl)-2-methyl-6-pyrrolidin-1-ylpyrimidin-5-amine (CID 83286314) is 4-(2-methoxyphenyl)-2-methyl-6-pyrrolidin-1-ylpyrimidin-5-amine.
What is the SMILES notation for 4-(2-methoxyphenyl)-2-methyl-6-pyrrolidin-1-ylpyrimidin-5-amine?
The canonical SMILES for 4-(2-methoxyphenyl)-2-methyl-6-pyrrolidin-1-ylpyrimidin-5-amine is COc1ccccc1-c1nc(C)nc(N2CCCC2)c1N.
What is the InChIKey of 4-(2-methoxyphenyl)-2-methyl-6-pyrrolidin-1-ylpyrimidin-5-amine?
The InChIKey is QXZXZCZWWMPSFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O/c1-11-18-15(12-7-3-4-8-13(12)21-2)14(17)16(19-11)20-9-5-6-10-20/h3-4,7-8H,5-6,9-10,17H2,1-2H3.
What are the key properties of 4-(2-methoxyphenyl)-2-methyl-6-pyrrolidin-1-ylpyrimidin-5-amine?
4-(2-methoxyphenyl)-2-methyl-6-pyrrolidin-1-ylpyrimidin-5-amine has a molecular weight of 284.36 g/mol, XLogP of 2.64, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methoxyphenyl)-2-methyl-6-pyrrolidin-1-ylpyrimidin-5-amine is sourced from PubChem (CID 83286314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).