2-(ethylamino)-8-(2-methoxyethyl)pteridin-7-one

C11H15N5O2 — CID 3235218

IUPAC2-(ethylamino)-8-(2-methoxyethyl)pteridin-7-one
SMILESCCNc1ncc2ncc(=O)n(CCOC)c2n1
InChIInChI=1S/C11H15N5O2/c1-3-12-11-14-6-8-10(15-11)16(4-5-18-2)9(17)7-13-8/h6-7H,3-5H2,1-2H3,(H,12,14,15)
InChIKeyVLBCVWVMZHGYGX-UHFFFAOYSA-N
MW249.27 g/mol
LogP0.26
Rot. Bonds5

About 2-(ethylamino)-8-(2-methoxyethyl)pteridin-7-one

2-(ethylamino)-8-(2-methoxyethyl)pteridin-7-one (PubChem CID 3235218) has the molecular formula C11H15N5O2 and a molecular weight of 249.27 g/mol. Its IUPAC name is 2-(ethylamino)-8-(2-methoxyethyl)pteridin-7-one.

Molecular Properties

Compound Name2-(ethylamino)-8-(2-methoxyethyl)pteridin-7-one
PubChem CID3235218
Molecular FormulaC11H15N5O2
Molecular Weight249.27 g/mol
Exact Mass249.12
IUPAC Name2-(ethylamino)-8-(2-methoxyethyl)pteridin-7-one
SMILESCCNc1ncc2ncc(=O)n(CCOC)c2n1
InChIInChI=1S/C11H15N5O2/c1-3-12-11-14-6-8-10(15-11)16(4-5-18-2)9(17)7-13-8/h6-7H,3-5H2,1-2H3,(H,12,14,15)
InChIKeyVLBCVWVMZHGYGX-UHFFFAOYSA-N
XLogP0.26
TPSA81.93 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.27
LogP ≤ 50.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-8-(2-methoxyethyl)pteridin-7-one?
The IUPAC name of 2-(ethylamino)-8-(2-methoxyethyl)pteridin-7-one (CID 3235218) is 2-(ethylamino)-8-(2-methoxyethyl)pteridin-7-one.
What is the SMILES notation for 2-(ethylamino)-8-(2-methoxyethyl)pteridin-7-one?
The canonical SMILES for 2-(ethylamino)-8-(2-methoxyethyl)pteridin-7-one is CCNc1ncc2ncc(=O)n(CCOC)c2n1.
What is the InChIKey of 2-(ethylamino)-8-(2-methoxyethyl)pteridin-7-one?
The InChIKey is VLBCVWVMZHGYGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5O2/c1-3-12-11-14-6-8-10(15-11)16(4-5-18-2)9(17)7-13-8/h6-7H,3-5H2,1-2H3,(H,12,14,15).
What are the key properties of 2-(ethylamino)-8-(2-methoxyethyl)pteridin-7-one?
2-(ethylamino)-8-(2-methoxyethyl)pteridin-7-one has a molecular weight of 249.27 g/mol, XLogP of 0.26, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-8-(2-methoxyethyl)pteridin-7-one is sourced from PubChem (CID 3235218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).