4-ethoxy-6-(4-ethylphenyl)pteridin-2-amine

C16H17N5O — CID 11770882

IUPAC4-ethoxy-6-(4-ethylphenyl)pteridin-2-amine
SMILESCCOc1nc(N)nc2ncc(-c3ccc(CC)cc3)nc12
InChIInChI=1S/C16H17N5O/c1-3-10-5-7-11(8-6-10)12-9-18-14-13(19-12)15(22-4-2)21-16(17)20-14/h5-9H,3-4H2,1-2H3,(H2,17,18,20,21)
InChIKeyORBNSMPWLYWERN-UHFFFAOYSA-N
MW295.35 g/mol
LogP2.63
Rot. Bonds4

About 4-ethoxy-6-(4-ethylphenyl)pteridin-2-amine

4-ethoxy-6-(4-ethylphenyl)pteridin-2-amine (PubChem CID 11770882) has the molecular formula C16H17N5O and a molecular weight of 295.35 g/mol. Its IUPAC name is 4-ethoxy-6-(4-ethylphenyl)pteridin-2-amine.

Molecular Properties

Compound Name4-ethoxy-6-(4-ethylphenyl)pteridin-2-amine
PubChem CID11770882
Molecular FormulaC16H17N5O
Molecular Weight295.35 g/mol
Exact Mass295.14
IUPAC Name4-ethoxy-6-(4-ethylphenyl)pteridin-2-amine
SMILESCCOc1nc(N)nc2ncc(-c3ccc(CC)cc3)nc12
InChIInChI=1S/C16H17N5O/c1-3-10-5-7-11(8-6-10)12-9-18-14-13(19-12)15(22-4-2)21-16(17)20-14/h5-9H,3-4H2,1-2H3,(H2,17,18,20,21)
InChIKeyORBNSMPWLYWERN-UHFFFAOYSA-N
XLogP2.63
TPSA86.81 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.35
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-6-(4-ethylphenyl)pteridin-2-amine?
The IUPAC name of 4-ethoxy-6-(4-ethylphenyl)pteridin-2-amine (CID 11770882) is 4-ethoxy-6-(4-ethylphenyl)pteridin-2-amine.
What is the SMILES notation for 4-ethoxy-6-(4-ethylphenyl)pteridin-2-amine?
The canonical SMILES for 4-ethoxy-6-(4-ethylphenyl)pteridin-2-amine is CCOc1nc(N)nc2ncc(-c3ccc(CC)cc3)nc12.
What is the InChIKey of 4-ethoxy-6-(4-ethylphenyl)pteridin-2-amine?
The InChIKey is ORBNSMPWLYWERN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N5O/c1-3-10-5-7-11(8-6-10)12-9-18-14-13(19-12)15(22-4-2)21-16(17)20-14/h5-9H,3-4H2,1-2H3,(H2,17,18,20,21).
What are the key properties of 4-ethoxy-6-(4-ethylphenyl)pteridin-2-amine?
4-ethoxy-6-(4-ethylphenyl)pteridin-2-amine has a molecular weight of 295.35 g/mol, XLogP of 2.63, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-6-(4-ethylphenyl)pteridin-2-amine is sourced from PubChem (CID 11770882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).