4-ethoxy-6-(furan-2-yl)pteridin-2-amine

C12H11N5O2 — CID 24794720

IUPAC4-ethoxy-6-(furan-2-yl)pteridin-2-amine
SMILESCCOc1nc(N)nc2ncc(-c3ccco3)nc12
InChIInChI=1S/C12H11N5O2/c1-2-18-11-9-10(16-12(13)17-11)14-6-7(15-9)8-4-3-5-19-8/h3-6H,2H2,1H3,(H2,13,14,16,17)
InChIKeySMTIGAWQYOYTPG-UHFFFAOYSA-N
MW257.25 g/mol
LogP1.66
Rot. Bonds3

About 4-ethoxy-6-(furan-2-yl)pteridin-2-amine

4-ethoxy-6-(furan-2-yl)pteridin-2-amine (PubChem CID 24794720) has the molecular formula C12H11N5O2 and a molecular weight of 257.25 g/mol. Its IUPAC name is 4-ethoxy-6-(furan-2-yl)pteridin-2-amine.

Molecular Properties

Compound Name4-ethoxy-6-(furan-2-yl)pteridin-2-amine
PubChem CID24794720
Molecular FormulaC12H11N5O2
Molecular Weight257.25 g/mol
Exact Mass257.09
IUPAC Name4-ethoxy-6-(furan-2-yl)pteridin-2-amine
SMILESCCOc1nc(N)nc2ncc(-c3ccco3)nc12
InChIInChI=1S/C12H11N5O2/c1-2-18-11-9-10(16-12(13)17-11)14-6-7(15-9)8-4-3-5-19-8/h3-6H,2H2,1H3,(H2,13,14,16,17)
InChIKeySMTIGAWQYOYTPG-UHFFFAOYSA-N
XLogP1.66
TPSA99.95 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.25
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-6-(furan-2-yl)pteridin-2-amine?
The IUPAC name of 4-ethoxy-6-(furan-2-yl)pteridin-2-amine (CID 24794720) is 4-ethoxy-6-(furan-2-yl)pteridin-2-amine.
What is the SMILES notation for 4-ethoxy-6-(furan-2-yl)pteridin-2-amine?
The canonical SMILES for 4-ethoxy-6-(furan-2-yl)pteridin-2-amine is CCOc1nc(N)nc2ncc(-c3ccco3)nc12.
What is the InChIKey of 4-ethoxy-6-(furan-2-yl)pteridin-2-amine?
The InChIKey is SMTIGAWQYOYTPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N5O2/c1-2-18-11-9-10(16-12(13)17-11)14-6-7(15-9)8-4-3-5-19-8/h3-6H,2H2,1H3,(H2,13,14,16,17).
What are the key properties of 4-ethoxy-6-(furan-2-yl)pteridin-2-amine?
4-ethoxy-6-(furan-2-yl)pteridin-2-amine has a molecular weight of 257.25 g/mol, XLogP of 1.66, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-6-(furan-2-yl)pteridin-2-amine is sourced from PubChem (CID 24794720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).