8-[2-(2-methoxyphenyl)ethyl]pteridin-7-one

C15H14N4O2 — CID 3232736

IUPAC8-[2-(2-methoxyphenyl)ethyl]pteridin-7-one
SMILESCOc1ccccc1CCn1c(=O)cnc2cncnc21
InChIInChI=1S/C15H14N4O2/c1-21-13-5-3-2-4-11(13)6-7-19-14(20)9-17-12-8-16-10-18-15(12)19/h2-5,8-10H,6-7H2,1H3
InChIKeyRDYXUOMIVUWDEF-UHFFFAOYSA-N
MW282.30 g/mol
LogP1.44
Rot. Bonds4

About 8-[2-(2-methoxyphenyl)ethyl]pteridin-7-one

8-[2-(2-methoxyphenyl)ethyl]pteridin-7-one (PubChem CID 3232736) has the molecular formula C15H14N4O2 and a molecular weight of 282.30 g/mol. Its IUPAC name is 8-[2-(2-methoxyphenyl)ethyl]pteridin-7-one.

Molecular Properties

Compound Name8-[2-(2-methoxyphenyl)ethyl]pteridin-7-one
PubChem CID3232736
Molecular FormulaC15H14N4O2
Molecular Weight282.30 g/mol
Exact Mass282.11
IUPAC Name8-[2-(2-methoxyphenyl)ethyl]pteridin-7-one
SMILESCOc1ccccc1CCn1c(=O)cnc2cncnc21
InChIInChI=1S/C15H14N4O2/c1-21-13-5-3-2-4-11(13)6-7-19-14(20)9-17-12-8-16-10-18-15(12)19/h2-5,8-10H,6-7H2,1H3
InChIKeyRDYXUOMIVUWDEF-UHFFFAOYSA-N
XLogP1.44
TPSA69.90 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.30
LogP ≤ 51.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

8-ethyl-2-(4-methoxyphenylamino)-8H-pyrido[2,3-d]pyrimidin-7-one
CID 5330211
[4,4-Bipyrimidin]-6(1h)-one, 2-[(2s)-2-(2-methoxyphenyl)-4-morpholinyl]-1-methyl-
CID 57798492
2-(cyclopropylamino)-7-(2-methoxybenzyl)-9-phenyl-7H-purin-8(9H)-one
CID 44564883
2-(cyclopropylamino)-7-(2-methoxybenzyl)-9-m-tolyl-7H-purin-8(9H)-one
CID 44564927
N-[(2,5-dimethoxyphenyl)methyl]-2-fluoro-N-(4-phenoxypyrimidin-5-yl)acetamide
CID 70682573
8-(4-Aminophenyl)-2-(4-methoxy-2-methylanilino)pteridin-7-one
CID 145360589
6-(4-Methoxyphenyl)-8-[(3-methoxyphenyl)methyl]-2-morpholin-4-ylpteridin-7-one
CID 3234621
6-(3,5-Difluorophenyl)-8-(2-methoxyethyl)-2-(4-methoxyphenoxy)pteridin-7-one
CID 3232614
3-[2-(4-Methoxyphenoxy)-7-oxopteridin-8-yl]propanenitrile
CID 3232620
2-(Dimethylamino)-8-[(3-methoxyphenyl)methyl]-6-(2-phenylethyl)pteridin-7-one
CID 3232624
8-Cyclopropyl-2-methoxy-6-(4-methoxyphenyl)pteridin-7-one
CID 3232662
2-(3-Methoxyanilino)-8-methylpteridin-7-one
CID 3232670

Frequently Asked Questions

What is the IUPAC name of 8-[2-(2-methoxyphenyl)ethyl]pteridin-7-one?
The IUPAC name of 8-[2-(2-methoxyphenyl)ethyl]pteridin-7-one (CID 3232736) is 8-[2-(2-methoxyphenyl)ethyl]pteridin-7-one.
What is the SMILES notation for 8-[2-(2-methoxyphenyl)ethyl]pteridin-7-one?
The canonical SMILES for 8-[2-(2-methoxyphenyl)ethyl]pteridin-7-one is COc1ccccc1CCn1c(=O)cnc2cncnc21.
What is the InChIKey of 8-[2-(2-methoxyphenyl)ethyl]pteridin-7-one?
The InChIKey is RDYXUOMIVUWDEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O2/c1-21-13-5-3-2-4-11(13)6-7-19-14(20)9-17-12-8-16-10-18-15(12)19/h2-5,8-10H,6-7H2,1H3.
What are the key properties of 8-[2-(2-methoxyphenyl)ethyl]pteridin-7-one?
8-[2-(2-methoxyphenyl)ethyl]pteridin-7-one has a molecular weight of 282.30 g/mol, XLogP of 1.44, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[2-(2-methoxyphenyl)ethyl]pteridin-7-one is sourced from PubChem (CID 3232736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).