6-amino-2-methoxy-3-(2-morpholin-4-ylethyl)pyrimidin-4-one

C11H18N4O3 — CID 11615807

IUPAC6-amino-2-methoxy-3-(2-morpholin-4-ylethyl)pyrimidin-4-one
SMILESCOc1nc(N)cc(=O)n1CCN1CCOCC1
InChIInChI=1S/C11H18N4O3/c1-17-11-13-9(12)8-10(16)15(11)3-2-14-4-6-18-7-5-14/h8H,2-7,12H2,1H3
InChIKeyXXHJAFQECGRFQV-UHFFFAOYSA-N
MW254.29 g/mol
LogP-0.83
Rot. Bonds4

About 6-amino-2-methoxy-3-(2-morpholin-4-ylethyl)pyrimidin-4-one

6-amino-2-methoxy-3-(2-morpholin-4-ylethyl)pyrimidin-4-one (PubChem CID 11615807) has the molecular formula C11H18N4O3 and a molecular weight of 254.29 g/mol. Its IUPAC name is 6-amino-2-methoxy-3-(2-morpholin-4-ylethyl)pyrimidin-4-one.

Molecular Properties

Compound Name6-amino-2-methoxy-3-(2-morpholin-4-ylethyl)pyrimidin-4-one
PubChem CID11615807
Molecular FormulaC11H18N4O3
Molecular Weight254.29 g/mol
Exact Mass254.14
IUPAC Name6-amino-2-methoxy-3-(2-morpholin-4-ylethyl)pyrimidin-4-one
SMILESCOc1nc(N)cc(=O)n1CCN1CCOCC1
InChIInChI=1S/C11H18N4O3/c1-17-11-13-9(12)8-10(16)15(11)3-2-14-4-6-18-7-5-14/h8H,2-7,12H2,1H3
InChIKeyXXHJAFQECGRFQV-UHFFFAOYSA-N
XLogP-0.83
TPSA82.61 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.29
LogP ≤ 5-0.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 6-amino-2-methoxy-3-(2-morpholin-4-ylethyl)pyrimidin-4-one?
The IUPAC name of 6-amino-2-methoxy-3-(2-morpholin-4-ylethyl)pyrimidin-4-one (CID 11615807) is 6-amino-2-methoxy-3-(2-morpholin-4-ylethyl)pyrimidin-4-one.
What is the SMILES notation for 6-amino-2-methoxy-3-(2-morpholin-4-ylethyl)pyrimidin-4-one?
The canonical SMILES for 6-amino-2-methoxy-3-(2-morpholin-4-ylethyl)pyrimidin-4-one is COc1nc(N)cc(=O)n1CCN1CCOCC1.
What is the InChIKey of 6-amino-2-methoxy-3-(2-morpholin-4-ylethyl)pyrimidin-4-one?
The InChIKey is XXHJAFQECGRFQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O3/c1-17-11-13-9(12)8-10(16)15(11)3-2-14-4-6-18-7-5-14/h8H,2-7,12H2,1H3.
What are the key properties of 6-amino-2-methoxy-3-(2-morpholin-4-ylethyl)pyrimidin-4-one?
6-amino-2-methoxy-3-(2-morpholin-4-ylethyl)pyrimidin-4-one has a molecular weight of 254.29 g/mol, XLogP of -0.83, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-2-methoxy-3-(2-morpholin-4-ylethyl)pyrimidin-4-one is sourced from PubChem (CID 11615807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).