2-(dimethylamino)-8-(4-methoxyphenyl)pteridin-7-one

C15H15N5O2 — CID 3233184

IUPAC2-(dimethylamino)-8-(4-methoxyphenyl)pteridin-7-one
SMILESCOc1ccc(-n2c(=O)cnc3cnc(N(C)C)nc32)cc1
InChIInChI=1S/C15H15N5O2/c1-19(2)15-17-8-12-14(18-15)20(13(21)9-16-12)10-4-6-11(22-3)7-5-10/h4-9H,1-3H3
InChIKeyRIOMZFPBFHOKAX-UHFFFAOYSA-N
MW297.32 g/mol
LogP1.25
Rot. Bonds3

About 2-(dimethylamino)-8-(4-methoxyphenyl)pteridin-7-one

2-(dimethylamino)-8-(4-methoxyphenyl)pteridin-7-one (PubChem CID 3233184) has the molecular formula C15H15N5O2 and a molecular weight of 297.32 g/mol. Its IUPAC name is 2-(dimethylamino)-8-(4-methoxyphenyl)pteridin-7-one.

Molecular Properties

Compound Name2-(dimethylamino)-8-(4-methoxyphenyl)pteridin-7-one
PubChem CID3233184
Molecular FormulaC15H15N5O2
Molecular Weight297.32 g/mol
Exact Mass297.12
IUPAC Name2-(dimethylamino)-8-(4-methoxyphenyl)pteridin-7-one
SMILESCOc1ccc(-n2c(=O)cnc3cnc(N(C)C)nc32)cc1
InChIInChI=1S/C15H15N5O2/c1-19(2)15-17-8-12-14(18-15)20(13(21)9-16-12)10-4-6-11(22-3)7-5-10/h4-9H,1-3H3
InChIKeyRIOMZFPBFHOKAX-UHFFFAOYSA-N
XLogP1.25
TPSA73.14 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.32
LogP ≤ 51.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-8-(4-methoxyphenyl)pteridin-7-one?
The IUPAC name of 2-(dimethylamino)-8-(4-methoxyphenyl)pteridin-7-one (CID 3233184) is 2-(dimethylamino)-8-(4-methoxyphenyl)pteridin-7-one.
What is the SMILES notation for 2-(dimethylamino)-8-(4-methoxyphenyl)pteridin-7-one?
The canonical SMILES for 2-(dimethylamino)-8-(4-methoxyphenyl)pteridin-7-one is COc1ccc(-n2c(=O)cnc3cnc(N(C)C)nc32)cc1.
What is the InChIKey of 2-(dimethylamino)-8-(4-methoxyphenyl)pteridin-7-one?
The InChIKey is RIOMZFPBFHOKAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N5O2/c1-19(2)15-17-8-12-14(18-15)20(13(21)9-16-12)10-4-6-11(22-3)7-5-10/h4-9H,1-3H3.
What are the key properties of 2-(dimethylamino)-8-(4-methoxyphenyl)pteridin-7-one?
2-(dimethylamino)-8-(4-methoxyphenyl)pteridin-7-one has a molecular weight of 297.32 g/mol, XLogP of 1.25, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-8-(4-methoxyphenyl)pteridin-7-one is sourced from PubChem (CID 3233184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).