2-methoxy-5-(morpholin-4-ylmethyl)-1H-pyrimidin-6-one

C10H15N3O3 — CID 134170552

IUPAC2-methoxy-5-(morpholin-4-ylmethyl)-1H-pyrimidin-6-one
SMILESCOc1ncc(CN2CCOCC2)c(=O)[nH]1
InChIInChI=1S/C10H15N3O3/c1-15-10-11-6-8(9(14)12-10)7-13-2-4-16-5-3-13/h6H,2-5,7H2,1H3,(H,11,12,14)
InChIKeyDDACEXUGAWRAEJ-UHFFFAOYSA-N
MW225.25 g/mol
LogP-0.39
Rot. Bonds3

About 2-methoxy-5-(morpholin-4-ylmethyl)-1H-pyrimidin-6-one

2-methoxy-5-(morpholin-4-ylmethyl)-1H-pyrimidin-6-one (PubChem CID 134170552) has the molecular formula C10H15N3O3 and a molecular weight of 225.25 g/mol. Its IUPAC name is 2-methoxy-5-(morpholin-4-ylmethyl)-1H-pyrimidin-6-one.

Molecular Properties

Compound Name2-methoxy-5-(morpholin-4-ylmethyl)-1H-pyrimidin-6-one
PubChem CID134170552
Molecular FormulaC10H15N3O3
Molecular Weight225.25 g/mol
Exact Mass225.11
IUPAC Name2-methoxy-5-(morpholin-4-ylmethyl)-1H-pyrimidin-6-one
SMILESCOc1ncc(CN2CCOCC2)c(=O)[nH]1
InChIInChI=1S/C10H15N3O3/c1-15-10-11-6-8(9(14)12-10)7-13-2-4-16-5-3-13/h6H,2-5,7H2,1H3,(H,11,12,14)
InChIKeyDDACEXUGAWRAEJ-UHFFFAOYSA-N
XLogP-0.39
TPSA67.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.25
LogP ≤ 5-0.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-5-(morpholin-4-ylmethyl)-1H-pyrimidin-6-one?
The IUPAC name of 2-methoxy-5-(morpholin-4-ylmethyl)-1H-pyrimidin-6-one (CID 134170552) is 2-methoxy-5-(morpholin-4-ylmethyl)-1H-pyrimidin-6-one.
What is the SMILES notation for 2-methoxy-5-(morpholin-4-ylmethyl)-1H-pyrimidin-6-one?
The canonical SMILES for 2-methoxy-5-(morpholin-4-ylmethyl)-1H-pyrimidin-6-one is COc1ncc(CN2CCOCC2)c(=O)[nH]1.
What is the InChIKey of 2-methoxy-5-(morpholin-4-ylmethyl)-1H-pyrimidin-6-one?
The InChIKey is DDACEXUGAWRAEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O3/c1-15-10-11-6-8(9(14)12-10)7-13-2-4-16-5-3-13/h6H,2-5,7H2,1H3,(H,11,12,14).
What are the key properties of 2-methoxy-5-(morpholin-4-ylmethyl)-1H-pyrimidin-6-one?
2-methoxy-5-(morpholin-4-ylmethyl)-1H-pyrimidin-6-one has a molecular weight of 225.25 g/mol, XLogP of -0.39, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-5-(morpholin-4-ylmethyl)-1H-pyrimidin-6-one is sourced from PubChem (CID 134170552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).