3-(4,6-dimethyl-2-phenylpyrimidin-5-yl)propan-1-amine

C15H19N3 — CID 28916529

IUPAC3-(4,6-dimethyl-2-phenylpyrimidin-5-yl)propan-1-amine
SMILESCc1nc(-c2ccccc2)nc(C)c1CCCN
InChIInChI=1S/C15H19N3/c1-11-14(9-6-10-16)12(2)18-15(17-11)13-7-4-3-5-8-13/h3-5,7-8H,6,9-10,16H2,1-2H3
InChIKeyVPMVQRDYGZYZMX-UHFFFAOYSA-N
MW241.34 g/mol
LogP2.65
Rot. Bonds4

About 3-(4,6-dimethyl-2-phenylpyrimidin-5-yl)propan-1-amine

3-(4,6-dimethyl-2-phenylpyrimidin-5-yl)propan-1-amine (PubChem CID 28916529) has the molecular formula C15H19N3 and a molecular weight of 241.34 g/mol. Its IUPAC name is 3-(4,6-dimethyl-2-phenylpyrimidin-5-yl)propan-1-amine.

Molecular Properties

Compound Name3-(4,6-dimethyl-2-phenylpyrimidin-5-yl)propan-1-amine
PubChem CID28916529
Molecular FormulaC15H19N3
Molecular Weight241.34 g/mol
Exact Mass241.16
IUPAC Name3-(4,6-dimethyl-2-phenylpyrimidin-5-yl)propan-1-amine
SMILESCc1nc(-c2ccccc2)nc(C)c1CCCN
InChIInChI=1S/C15H19N3/c1-11-14(9-6-10-16)12(2)18-15(17-11)13-7-4-3-5-8-13/h3-5,7-8H,6,9-10,16H2,1-2H3
InChIKeyVPMVQRDYGZYZMX-UHFFFAOYSA-N
XLogP2.65
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.34
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-(4,6-dimethyl-2-phenylpyrimidin-5-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

Frequently Asked Questions

What is the IUPAC name of 3-(4,6-dimethyl-2-phenylpyrimidin-5-yl)propan-1-amine?
The IUPAC name of 3-(4,6-dimethyl-2-phenylpyrimidin-5-yl)propan-1-amine (CID 28916529) is 3-(4,6-dimethyl-2-phenylpyrimidin-5-yl)propan-1-amine.
What is the SMILES notation for 3-(4,6-dimethyl-2-phenylpyrimidin-5-yl)propan-1-amine?
The canonical SMILES for 3-(4,6-dimethyl-2-phenylpyrimidin-5-yl)propan-1-amine is Cc1nc(-c2ccccc2)nc(C)c1CCCN.
What is the InChIKey of 3-(4,6-dimethyl-2-phenylpyrimidin-5-yl)propan-1-amine?
The InChIKey is VPMVQRDYGZYZMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3/c1-11-14(9-6-10-16)12(2)18-15(17-11)13-7-4-3-5-8-13/h3-5,7-8H,6,9-10,16H2,1-2H3.
What are the key properties of 3-(4,6-dimethyl-2-phenylpyrimidin-5-yl)propan-1-amine?
3-(4,6-dimethyl-2-phenylpyrimidin-5-yl)propan-1-amine has a molecular weight of 241.34 g/mol, XLogP of 2.65, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4,6-dimethyl-2-phenylpyrimidin-5-yl)propan-1-amine is sourced from PubChem (CID 28916529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).