5-fluoro-N-(4-methoxyphenyl)-4-morpholin-4-ylpyrimidin-2-amine

C15H17FN4O2 — CID 2210271

IUPAC5-fluoro-N-(4-methoxyphenyl)-4-morpholin-4-ylpyrimidin-2-amine
SMILESCOc1ccc(Nc2ncc(F)c(N3CCOCC3)n2)cc1
InChIInChI=1S/C15H17FN4O2/c1-21-12-4-2-11(3-5-12)18-15-17-10-13(16)14(19-15)20-6-8-22-9-7-20/h2-5,10H,6-9H2,1H3,(H,17,18,19)
InChIKeyZAKWOXFASIIAJK-UHFFFAOYSA-N
MW304.33 g/mol
LogP2.20
Rot. Bonds4

About 5-fluoro-N-(4-methoxyphenyl)-4-morpholin-4-ylpyrimidin-2-amine

5-fluoro-N-(4-methoxyphenyl)-4-morpholin-4-ylpyrimidin-2-amine (PubChem CID 2210271) has the molecular formula C15H17FN4O2 and a molecular weight of 304.33 g/mol. Its IUPAC name is 5-fluoro-N-(4-methoxyphenyl)-4-morpholin-4-ylpyrimidin-2-amine.

Molecular Properties

Compound Name5-fluoro-N-(4-methoxyphenyl)-4-morpholin-4-ylpyrimidin-2-amine
PubChem CID2210271
Molecular FormulaC15H17FN4O2
Molecular Weight304.33 g/mol
Exact Mass304.13
IUPAC Name5-fluoro-N-(4-methoxyphenyl)-4-morpholin-4-ylpyrimidin-2-amine
SMILESCOc1ccc(Nc2ncc(F)c(N3CCOCC3)n2)cc1
InChIInChI=1S/C15H17FN4O2/c1-21-12-4-2-11(3-5-12)18-15-17-10-13(16)14(19-15)20-6-8-22-9-7-20/h2-5,10H,6-9H2,1H3,(H,17,18,19)
InChIKeyZAKWOXFASIIAJK-UHFFFAOYSA-N
XLogP2.20
TPSA59.51 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.33
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 5-fluoro-N-(4-methoxyphenyl)-4-morpholin-4-ylpyrimidin-2-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 5-fluoro-N-(4-methoxyphenyl)-4-morpholin-4-ylpyrimidin-2-amine?
The IUPAC name of 5-fluoro-N-(4-methoxyphenyl)-4-morpholin-4-ylpyrimidin-2-amine (CID 2210271) is 5-fluoro-N-(4-methoxyphenyl)-4-morpholin-4-ylpyrimidin-2-amine.
What is the SMILES notation for 5-fluoro-N-(4-methoxyphenyl)-4-morpholin-4-ylpyrimidin-2-amine?
The canonical SMILES for 5-fluoro-N-(4-methoxyphenyl)-4-morpholin-4-ylpyrimidin-2-amine is COc1ccc(Nc2ncc(F)c(N3CCOCC3)n2)cc1.
What is the InChIKey of 5-fluoro-N-(4-methoxyphenyl)-4-morpholin-4-ylpyrimidin-2-amine?
The InChIKey is ZAKWOXFASIIAJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17FN4O2/c1-21-12-4-2-11(3-5-12)18-15-17-10-13(16)14(19-15)20-6-8-22-9-7-20/h2-5,10H,6-9H2,1H3,(H,17,18,19).
What are the key properties of 5-fluoro-N-(4-methoxyphenyl)-4-morpholin-4-ylpyrimidin-2-amine?
5-fluoro-N-(4-methoxyphenyl)-4-morpholin-4-ylpyrimidin-2-amine has a molecular weight of 304.33 g/mol, XLogP of 2.20, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-N-(4-methoxyphenyl)-4-morpholin-4-ylpyrimidin-2-amine is sourced from PubChem (CID 2210271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).