7-(4-morpholin-4-ylphenyl)pteridin-4-amine

C16H16N6O — CID 11023238

IUPAC7-(4-morpholin-4-ylphenyl)pteridin-4-amine
SMILESNc1ncnc2nc(-c3ccc(N4CCOCC4)cc3)cnc12
InChIInChI=1S/C16H16N6O/c17-15-14-16(20-10-19-15)21-13(9-18-14)11-1-3-12(4-2-11)22-5-7-23-8-6-22/h1-4,9-10H,5-8H2,(H2,17,19,20,21)
InChIKeyWZEORQJKFFGZDN-UHFFFAOYSA-N
MW308.35 g/mol
LogP1.51
Rot. Bonds2

About 7-(4-morpholin-4-ylphenyl)pteridin-4-amine

7-(4-morpholin-4-ylphenyl)pteridin-4-amine (PubChem CID 11023238) has the molecular formula C16H16N6O and a molecular weight of 308.35 g/mol. Its IUPAC name is 7-(4-morpholin-4-ylphenyl)pteridin-4-amine.

Molecular Properties

Compound Name7-(4-morpholin-4-ylphenyl)pteridin-4-amine
PubChem CID11023238
Molecular FormulaC16H16N6O
Molecular Weight308.35 g/mol
Exact Mass308.14
IUPAC Name7-(4-morpholin-4-ylphenyl)pteridin-4-amine
SMILESNc1ncnc2nc(-c3ccc(N4CCOCC4)cc3)cnc12
InChIInChI=1S/C16H16N6O/c17-15-14-16(20-10-19-15)21-13(9-18-14)11-1-3-12(4-2-11)22-5-7-23-8-6-22/h1-4,9-10H,5-8H2,(H2,17,19,20,21)
InChIKeyWZEORQJKFFGZDN-UHFFFAOYSA-N
XLogP1.51
TPSA90.05 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.35
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 7-(4-morpholin-4-ylphenyl)pteridin-4-amine?
The IUPAC name of 7-(4-morpholin-4-ylphenyl)pteridin-4-amine (CID 11023238) is 7-(4-morpholin-4-ylphenyl)pteridin-4-amine.
What is the SMILES notation for 7-(4-morpholin-4-ylphenyl)pteridin-4-amine?
The canonical SMILES for 7-(4-morpholin-4-ylphenyl)pteridin-4-amine is Nc1ncnc2nc(-c3ccc(N4CCOCC4)cc3)cnc12.
What is the InChIKey of 7-(4-morpholin-4-ylphenyl)pteridin-4-amine?
The InChIKey is WZEORQJKFFGZDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N6O/c17-15-14-16(20-10-19-15)21-13(9-18-14)11-1-3-12(4-2-11)22-5-7-23-8-6-22/h1-4,9-10H,5-8H2,(H2,17,19,20,21).
What are the key properties of 7-(4-morpholin-4-ylphenyl)pteridin-4-amine?
7-(4-morpholin-4-ylphenyl)pteridin-4-amine has a molecular weight of 308.35 g/mol, XLogP of 1.51, 2 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(4-morpholin-4-ylphenyl)pteridin-4-amine is sourced from PubChem (CID 11023238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).