2-morpholin-4-yl-8-(2-phenylethyl)pteridin-7-one

C18H19N5O2 — CID 3233256

IUPAC2-morpholin-4-yl-8-(2-phenylethyl)pteridin-7-one
SMILESO=c1cnc2cnc(N3CCOCC3)nc2n1CCc1ccccc1
InChIInChI=1S/C18H19N5O2/c24-16-13-19-15-12-20-18(22-8-10-25-11-9-22)21-17(15)23(16)7-6-14-4-2-1-3-5-14/h1-5,12-13H,6-11H2
InChIKeyHRAFPBMWOKJXOZ-UHFFFAOYSA-N
MW337.38 g/mol
LogP1.27
Rot. Bonds4

About 2-morpholin-4-yl-8-(2-phenylethyl)pteridin-7-one

2-morpholin-4-yl-8-(2-phenylethyl)pteridin-7-one (PubChem CID 3233256) has the molecular formula C18H19N5O2 and a molecular weight of 337.38 g/mol. Its IUPAC name is 2-morpholin-4-yl-8-(2-phenylethyl)pteridin-7-one.

Molecular Properties

Compound Name2-morpholin-4-yl-8-(2-phenylethyl)pteridin-7-one
PubChem CID3233256
Molecular FormulaC18H19N5O2
Molecular Weight337.38 g/mol
Exact Mass337.15
IUPAC Name2-morpholin-4-yl-8-(2-phenylethyl)pteridin-7-one
SMILESO=c1cnc2cnc(N3CCOCC3)nc2n1CCc1ccccc1
InChIInChI=1S/C18H19N5O2/c24-16-13-19-15-12-20-18(22-8-10-25-11-9-22)21-17(15)23(16)7-6-14-4-2-1-3-5-14/h1-5,12-13H,6-11H2
InChIKeyHRAFPBMWOKJXOZ-UHFFFAOYSA-N
XLogP1.27
TPSA73.14 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.38
LogP ≤ 51.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-morpholin-4-yl-8-(2-phenylethyl)pteridin-7-one?
The IUPAC name of 2-morpholin-4-yl-8-(2-phenylethyl)pteridin-7-one (CID 3233256) is 2-morpholin-4-yl-8-(2-phenylethyl)pteridin-7-one.
What is the SMILES notation for 2-morpholin-4-yl-8-(2-phenylethyl)pteridin-7-one?
The canonical SMILES for 2-morpholin-4-yl-8-(2-phenylethyl)pteridin-7-one is O=c1cnc2cnc(N3CCOCC3)nc2n1CCc1ccccc1.
What is the InChIKey of 2-morpholin-4-yl-8-(2-phenylethyl)pteridin-7-one?
The InChIKey is HRAFPBMWOKJXOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N5O2/c24-16-13-19-15-12-20-18(22-8-10-25-11-9-22)21-17(15)23(16)7-6-14-4-2-1-3-5-14/h1-5,12-13H,6-11H2.
What are the key properties of 2-morpholin-4-yl-8-(2-phenylethyl)pteridin-7-one?
2-morpholin-4-yl-8-(2-phenylethyl)pteridin-7-one has a molecular weight of 337.38 g/mol, XLogP of 1.27, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-morpholin-4-yl-8-(2-phenylethyl)pteridin-7-one is sourced from PubChem (CID 3233256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).