4-[2-(2-methyl-1,5-dihydropyrazol-4-yl)ethoxy]-6-morpholin-4-ylpyrimidin-2-amine

C14H22N6O2 — CID 156831860

IUPAC4-[2-(2-methyl-1,5-dihydropyrazol-4-yl)ethoxy]-6-morpholin-4-ylpyrimidin-2-amine
SMILESCN1C=C(CCOc2cc(N3CCOCC3)nc(N)n2)CN1
InChIInChI=1S/C14H22N6O2/c1-19-10-11(9-16-19)2-5-22-13-8-12(17-14(15)18-13)20-3-6-21-7-4-20/h8,10,16H,2-7,9H2,1H3,(H2,15,17,18)
InChIKeyAUMZMXRVFMMTAB-UHFFFAOYSA-N
MW306.37 g/mol
LogP-0.00
Rot. Bonds5

About 4-[2-(2-methyl-1,5-dihydropyrazol-4-yl)ethoxy]-6-morpholin-4-ylpyrimidin-2-amine

4-[2-(2-methyl-1,5-dihydropyrazol-4-yl)ethoxy]-6-morpholin-4-ylpyrimidin-2-amine (PubChem CID 156831860) has the molecular formula C14H22N6O2 and a molecular weight of 306.37 g/mol. Its IUPAC name is 4-[2-(2-methyl-1,5-dihydropyrazol-4-yl)ethoxy]-6-morpholin-4-ylpyrimidin-2-amine.

Molecular Properties

Compound Name4-[2-(2-methyl-1,5-dihydropyrazol-4-yl)ethoxy]-6-morpholin-4-ylpyrimidin-2-amine
PubChem CID156831860
Molecular FormulaC14H22N6O2
Molecular Weight306.37 g/mol
Exact Mass306.18
IUPAC Name4-[2-(2-methyl-1,5-dihydropyrazol-4-yl)ethoxy]-6-morpholin-4-ylpyrimidin-2-amine
SMILESCN1C=C(CCOc2cc(N3CCOCC3)nc(N)n2)CN1
InChIInChI=1S/C14H22N6O2/c1-19-10-11(9-16-19)2-5-22-13-8-12(17-14(15)18-13)20-3-6-21-7-4-20/h8,10,16H,2-7,9H2,1H3,(H2,15,17,18)
InChIKeyAUMZMXRVFMMTAB-UHFFFAOYSA-N
XLogP-0.00
TPSA88.77 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.37
LogP ≤ 5-0.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze 4-[2-(2-methyl-1,5-dihydropyrazol-4-yl)ethoxy]-6-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 4-[2-(2-methyl-1,5-dihydropyrazol-4-yl)ethoxy]-6-morpholin-4-ylpyrimidin-2-amine?
The IUPAC name of 4-[2-(2-methyl-1,5-dihydropyrazol-4-yl)ethoxy]-6-morpholin-4-ylpyrimidin-2-amine (CID 156831860) is 4-[2-(2-methyl-1,5-dihydropyrazol-4-yl)ethoxy]-6-morpholin-4-ylpyrimidin-2-amine.
What is the SMILES notation for 4-[2-(2-methyl-1,5-dihydropyrazol-4-yl)ethoxy]-6-morpholin-4-ylpyrimidin-2-amine?
The canonical SMILES for 4-[2-(2-methyl-1,5-dihydropyrazol-4-yl)ethoxy]-6-morpholin-4-ylpyrimidin-2-amine is CN1C=C(CCOc2cc(N3CCOCC3)nc(N)n2)CN1.
What is the InChIKey of 4-[2-(2-methyl-1,5-dihydropyrazol-4-yl)ethoxy]-6-morpholin-4-ylpyrimidin-2-amine?
The InChIKey is AUMZMXRVFMMTAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N6O2/c1-19-10-11(9-16-19)2-5-22-13-8-12(17-14(15)18-13)20-3-6-21-7-4-20/h8,10,16H,2-7,9H2,1H3,(H2,15,17,18).
What are the key properties of 4-[2-(2-methyl-1,5-dihydropyrazol-4-yl)ethoxy]-6-morpholin-4-ylpyrimidin-2-amine?
4-[2-(2-methyl-1,5-dihydropyrazol-4-yl)ethoxy]-6-morpholin-4-ylpyrimidin-2-amine has a molecular weight of 306.37 g/mol, XLogP of -0.00, 5 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(2-methyl-1,5-dihydropyrazol-4-yl)ethoxy]-6-morpholin-4-ylpyrimidin-2-amine is sourced from PubChem (CID 156831860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).