1-[4-(6-methoxypyrimidin-4-yl)morpholin-2-yl]ethanamine

C11H18N4O2 — CID 115315845

IUPAC1-[4-(6-methoxypyrimidin-4-yl)morpholin-2-yl]ethanamine
SMILESCOc1cc(N2CCOC(C(C)N)C2)ncn1
InChIInChI=1S/C11H18N4O2/c1-8(12)9-6-15(3-4-17-9)10-5-11(16-2)14-7-13-10/h5,7-9H,3-4,6,12H2,1-2H3
InChIKeyHWIOPOJKEXAYEF-UHFFFAOYSA-N
MW238.29 g/mol
LogP0.04
Rot. Bonds3

About 1-[4-(6-methoxypyrimidin-4-yl)morpholin-2-yl]ethanamine

1-[4-(6-methoxypyrimidin-4-yl)morpholin-2-yl]ethanamine (PubChem CID 115315845) has the molecular formula C11H18N4O2 and a molecular weight of 238.29 g/mol. Its IUPAC name is 1-[4-(6-methoxypyrimidin-4-yl)morpholin-2-yl]ethanamine.

Molecular Properties

Compound Name1-[4-(6-methoxypyrimidin-4-yl)morpholin-2-yl]ethanamine
PubChem CID115315845
Molecular FormulaC11H18N4O2
Molecular Weight238.29 g/mol
Exact Mass238.14
IUPAC Name1-[4-(6-methoxypyrimidin-4-yl)morpholin-2-yl]ethanamine
SMILESCOc1cc(N2CCOC(C(C)N)C2)ncn1
InChIInChI=1S/C11H18N4O2/c1-8(12)9-6-15(3-4-17-9)10-5-11(16-2)14-7-13-10/h5,7-9H,3-4,6,12H2,1-2H3
InChIKeyHWIOPOJKEXAYEF-UHFFFAOYSA-N
XLogP0.04
TPSA73.50 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 50.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-[4-(6-methoxypyrimidin-4-yl)morpholin-2-yl]ethanamine?
The IUPAC name of 1-[4-(6-methoxypyrimidin-4-yl)morpholin-2-yl]ethanamine (CID 115315845) is 1-[4-(6-methoxypyrimidin-4-yl)morpholin-2-yl]ethanamine.
What is the SMILES notation for 1-[4-(6-methoxypyrimidin-4-yl)morpholin-2-yl]ethanamine?
The canonical SMILES for 1-[4-(6-methoxypyrimidin-4-yl)morpholin-2-yl]ethanamine is COc1cc(N2CCOC(C(C)N)C2)ncn1.
What is the InChIKey of 1-[4-(6-methoxypyrimidin-4-yl)morpholin-2-yl]ethanamine?
The InChIKey is HWIOPOJKEXAYEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O2/c1-8(12)9-6-15(3-4-17-9)10-5-11(16-2)14-7-13-10/h5,7-9H,3-4,6,12H2,1-2H3.
What are the key properties of 1-[4-(6-methoxypyrimidin-4-yl)morpholin-2-yl]ethanamine?
1-[4-(6-methoxypyrimidin-4-yl)morpholin-2-yl]ethanamine has a molecular weight of 238.29 g/mol, XLogP of 0.04, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(6-methoxypyrimidin-4-yl)morpholin-2-yl]ethanamine is sourced from PubChem (CID 115315845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).