6-methoxy-5-methyl-N-(3-phenoxypropyl)pyrimidin-4-amine

C15H19N3O2 — CID 66324814

IUPAC6-methoxy-5-methyl-N-(3-phenoxypropyl)pyrimidin-4-amine
SMILESCOc1ncnc(NCCCOc2ccccc2)c1C
InChIInChI=1S/C15H19N3O2/c1-12-14(17-11-18-15(12)19-2)16-9-6-10-20-13-7-4-3-5-8-13/h3-5,7-8,11H,6,9-10H2,1-2H3,(H,16,17,18)
InChIKeyLPJVHRVKZOPWFE-UHFFFAOYSA-N
MW273.34 g/mol
LogP2.67
Rot. Bonds7

About 6-methoxy-5-methyl-N-(3-phenoxypropyl)pyrimidin-4-amine

6-methoxy-5-methyl-N-(3-phenoxypropyl)pyrimidin-4-amine (PubChem CID 66324814) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is 6-methoxy-5-methyl-N-(3-phenoxypropyl)pyrimidin-4-amine.

Molecular Properties

Compound Name6-methoxy-5-methyl-N-(3-phenoxypropyl)pyrimidin-4-amine
PubChem CID66324814
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC Name6-methoxy-5-methyl-N-(3-phenoxypropyl)pyrimidin-4-amine
SMILESCOc1ncnc(NCCCOc2ccccc2)c1C
InChIInChI=1S/C15H19N3O2/c1-12-14(17-11-18-15(12)19-2)16-9-6-10-20-13-7-4-3-5-8-13/h3-5,7-8,11H,6,9-10H2,1-2H3,(H,16,17,18)
InChIKeyLPJVHRVKZOPWFE-UHFFFAOYSA-N
XLogP2.67
TPSA56.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 6-methoxy-5-methyl-N-(3-phenoxypropyl)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

Related Compounds

6-methoxy-5-methyl-N-(2-phenylethyl)pyrimidin-4-amine
CID 66327861
6-methoxy-5-methyl-N-(3-propoxypropyl)pyrimidin-4-amine
CID 82943748
N-hexyl-6-methoxy-5-methylpyrimidin-4-amine
CID 66325235
6-methoxy-5-methyl-N-(3-phenylbutyl)pyrimidin-4-amine
CID 66325227
6-methoxy-5-methyl-N-propylpyrimidin-4-amine
CID 66326211
N-cyclopropyl-N'-(6-methoxy-5-methylpyrimidin-4-yl)propane-1,3-diamine
CID 66332349
5-ethyl-4-N-(3-phenoxypropyl)pyrimidine-4,6-diamine
CID 80826774
5-[(6-methoxy-5-methylpyrimidin-4-yl)amino]-2-methylpentan-1-ol
CID 106162116
N-(6-methoxy-5-methylpyrimidin-4-yl)-N',N'-dimethylethane-1,2-diamine
CID 66327244
3-methyl-N-(3-phenoxypropyl)pyridin-2-amine
CID 62379676
6-chloro-N-(3-phenoxypropyl)-5-propylpyrimidin-4-amine
CID 63729687
6-N,5-diethyl-4-N-(2-phenoxyethyl)pyrimidine-4,6-diamine
CID 80791055

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-5-methyl-N-(3-phenoxypropyl)pyrimidin-4-amine?
The IUPAC name of 6-methoxy-5-methyl-N-(3-phenoxypropyl)pyrimidin-4-amine (CID 66324814) is 6-methoxy-5-methyl-N-(3-phenoxypropyl)pyrimidin-4-amine.
What is the SMILES notation for 6-methoxy-5-methyl-N-(3-phenoxypropyl)pyrimidin-4-amine?
The canonical SMILES for 6-methoxy-5-methyl-N-(3-phenoxypropyl)pyrimidin-4-amine is COc1ncnc(NCCCOc2ccccc2)c1C.
What is the InChIKey of 6-methoxy-5-methyl-N-(3-phenoxypropyl)pyrimidin-4-amine?
The InChIKey is LPJVHRVKZOPWFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-12-14(17-11-18-15(12)19-2)16-9-6-10-20-13-7-4-3-5-8-13/h3-5,7-8,11H,6,9-10H2,1-2H3,(H,16,17,18).
What are the key properties of 6-methoxy-5-methyl-N-(3-phenoxypropyl)pyrimidin-4-amine?
6-methoxy-5-methyl-N-(3-phenoxypropyl)pyrimidin-4-amine has a molecular weight of 273.34 g/mol, XLogP of 2.67, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-5-methyl-N-(3-phenoxypropyl)pyrimidin-4-amine is sourced from PubChem (CID 66324814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).