5-[6-(methoxymethyl)-2-morpholin-4-ylpyrimidin-4-yl]pyrimidin-2-amine

C14H18N6O2 — CID 71012387

IUPAC5-[6-(methoxymethyl)-2-morpholin-4-ylpyrimidin-4-yl]pyrimidin-2-amine
SMILESCOCc1cc(-c2cnc(N)nc2)nc(N2CCOCC2)n1
InChIInChI=1S/C14H18N6O2/c1-21-9-11-6-12(10-7-16-13(15)17-8-10)19-14(18-11)20-2-4-22-5-3-20/h6-8H,2-5,9H2,1H3,(H2,15,16,17)
InChIKeyZJKGSSRGJKHBJB-UHFFFAOYSA-N
MW302.34 g/mol
LogP0.50
Rot. Bonds4

About 5-[6-(methoxymethyl)-2-morpholin-4-ylpyrimidin-4-yl]pyrimidin-2-amine

5-[6-(methoxymethyl)-2-morpholin-4-ylpyrimidin-4-yl]pyrimidin-2-amine (PubChem CID 71012387) has the molecular formula C14H18N6O2 and a molecular weight of 302.34 g/mol. Its IUPAC name is 5-[6-(methoxymethyl)-2-morpholin-4-ylpyrimidin-4-yl]pyrimidin-2-amine.

Molecular Properties

Compound Name5-[6-(methoxymethyl)-2-morpholin-4-ylpyrimidin-4-yl]pyrimidin-2-amine
PubChem CID71012387
Molecular FormulaC14H18N6O2
Molecular Weight302.34 g/mol
Exact Mass302.15
IUPAC Name5-[6-(methoxymethyl)-2-morpholin-4-ylpyrimidin-4-yl]pyrimidin-2-amine
SMILESCOCc1cc(-c2cnc(N)nc2)nc(N2CCOCC2)n1
InChIInChI=1S/C14H18N6O2/c1-21-9-11-6-12(10-7-16-13(15)17-8-10)19-14(18-11)20-2-4-22-5-3-20/h6-8H,2-5,9H2,1H3,(H2,15,16,17)
InChIKeyZJKGSSRGJKHBJB-UHFFFAOYSA-N
XLogP0.50
TPSA99.28 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.34
LogP ≤ 50.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 5-[6-(methoxymethyl)-2-morpholin-4-ylpyrimidin-4-yl]pyrimidin-2-amine?
The IUPAC name of 5-[6-(methoxymethyl)-2-morpholin-4-ylpyrimidin-4-yl]pyrimidin-2-amine (CID 71012387) is 5-[6-(methoxymethyl)-2-morpholin-4-ylpyrimidin-4-yl]pyrimidin-2-amine.
What is the SMILES notation for 5-[6-(methoxymethyl)-2-morpholin-4-ylpyrimidin-4-yl]pyrimidin-2-amine?
The canonical SMILES for 5-[6-(methoxymethyl)-2-morpholin-4-ylpyrimidin-4-yl]pyrimidin-2-amine is COCc1cc(-c2cnc(N)nc2)nc(N2CCOCC2)n1.
What is the InChIKey of 5-[6-(methoxymethyl)-2-morpholin-4-ylpyrimidin-4-yl]pyrimidin-2-amine?
The InChIKey is ZJKGSSRGJKHBJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N6O2/c1-21-9-11-6-12(10-7-16-13(15)17-8-10)19-14(18-11)20-2-4-22-5-3-20/h6-8H,2-5,9H2,1H3,(H2,15,16,17).
What are the key properties of 5-[6-(methoxymethyl)-2-morpholin-4-ylpyrimidin-4-yl]pyrimidin-2-amine?
5-[6-(methoxymethyl)-2-morpholin-4-ylpyrimidin-4-yl]pyrimidin-2-amine has a molecular weight of 302.34 g/mol, XLogP of 0.50, 4 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[6-(methoxymethyl)-2-morpholin-4-ylpyrimidin-4-yl]pyrimidin-2-amine is sourced from PubChem (CID 71012387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).