6-[2-(4-hydroxyphenyl)ethyl]-4-methylpyrano[3,2-c]pyridine-2,5-dione

C17H15NO4 — CID 135638868

IUPAC6-[2-(4-hydroxyphenyl)ethyl]-4-methylpyrano[3,2-c]pyridine-2,5-dione
SMILESCc1cc(=O)oc2ccn(CCc3ccc(O)cc3)c(=O)c12
InChIInChI=1S/C17H15NO4/c1-11-10-15(20)22-14-7-9-18(17(21)16(11)14)8-6-12-2-4-13(19)5-3-12/h2-5,7,9-10,19H,6,8H2,1H3
InChIKeyOZUUTYOAEQXBAP-UHFFFAOYSA-N
MW297.31 g/mol
LogP2.21
Rot. Bonds3

About 6-[2-(4-hydroxyphenyl)ethyl]-4-methylpyrano[3,2-c]pyridine-2,5-dione

6-[2-(4-hydroxyphenyl)ethyl]-4-methylpyrano[3,2-c]pyridine-2,5-dione (PubChem CID 135638868) has the molecular formula C17H15NO4 and a molecular weight of 297.31 g/mol. Its IUPAC name is 6-[2-(4-hydroxyphenyl)ethyl]-4-methylpyrano[3,2-c]pyridine-2,5-dione.

Molecular Properties

Compound Name6-[2-(4-hydroxyphenyl)ethyl]-4-methylpyrano[3,2-c]pyridine-2,5-dione
PubChem CID135638868
Molecular FormulaC17H15NO4
Molecular Weight297.31 g/mol
Exact Mass297.10
IUPAC Name6-[2-(4-hydroxyphenyl)ethyl]-4-methylpyrano[3,2-c]pyridine-2,5-dione
SMILESCc1cc(=O)oc2ccn(CCc3ccc(O)cc3)c(=O)c12
InChIInChI=1S/C17H15NO4/c1-11-10-15(20)22-14-7-9-18(17(21)16(11)14)8-6-12-2-4-13(19)5-3-12/h2-5,7,9-10,19H,6,8H2,1H3
InChIKeyOZUUTYOAEQXBAP-UHFFFAOYSA-N
XLogP2.21
TPSA72.44 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.31
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-Bromo-1-[2-(4-hydroxy-phenyl)-ethyl]-6-oxo-1,6-dihydro-pyridine-3-carboxylic acid methyl ester
CID 9551672
5-[2-(4-hydroxyphenyl)ethyl]-1,1-dimethyl-1H,5H-furo[3,4-c]pyridine-3,4-dione
CID 70686013
Ethyl 5-(4-hydroxyphenyl)-4-methoxy-1-methyl-2-oxopyridine-3-carboxylate
CID 90667379
(5S)-1-[2-(4-hydroxyphenyl)ethyl]-5-methoxy-3,5-dimethylpyrrol-2-one
CID 178299052
Methyl 5-bromo-1-[2-(4-hydroxyphenyl)ethyl]-6-oxo-1,6-dihydropyridine-3-carboxylate
CID 1384792
4-[(4-Fluorophenyl)methoxy]-1-[2-(4-hydroxyphenyl)ethyl]pyridin-2-one
CID 68426772
benzyl (E)-4-[2-(4-hydroxyphenyl)ethyl-(2,2,2-trifluoroacetyl)amino]-3-methylbut-2-enoate
CID 132078841
Methyl 4-[3-(4-hydroxyphenyl)prop-2-enoyl-methylamino]butanoate
CID 76874848
methyl (4Z)-1-[2-(cyclohex-1-en-1-yl)ethyl]-4-(4-hydroxybenzylidene)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
CID 5457778
Methyl 5-bromo-1-[2-(4-hydroxyphenyl)ethyl]-6-oxopyridine-3-carboxylate chloride
CID 53312731
8-(4-Methoxyphenyl)-4-oxoquinolizine-3-carboxylic acid
CID 9922174
Ethyl 3-cyano-2-(4-hydroxyphenyl)-4-oxoquinolizine-1-carboxylate
CID 15622490

Frequently Asked Questions

What is the IUPAC name of 6-[2-(4-hydroxyphenyl)ethyl]-4-methylpyrano[3,2-c]pyridine-2,5-dione?
The IUPAC name of 6-[2-(4-hydroxyphenyl)ethyl]-4-methylpyrano[3,2-c]pyridine-2,5-dione (CID 135638868) is 6-[2-(4-hydroxyphenyl)ethyl]-4-methylpyrano[3,2-c]pyridine-2,5-dione.
What is the SMILES notation for 6-[2-(4-hydroxyphenyl)ethyl]-4-methylpyrano[3,2-c]pyridine-2,5-dione?
The canonical SMILES for 6-[2-(4-hydroxyphenyl)ethyl]-4-methylpyrano[3,2-c]pyridine-2,5-dione is Cc1cc(=O)oc2ccn(CCc3ccc(O)cc3)c(=O)c12.
What is the InChIKey of 6-[2-(4-hydroxyphenyl)ethyl]-4-methylpyrano[3,2-c]pyridine-2,5-dione?
The InChIKey is OZUUTYOAEQXBAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15NO4/c1-11-10-15(20)22-14-7-9-18(17(21)16(11)14)8-6-12-2-4-13(19)5-3-12/h2-5,7,9-10,19H,6,8H2,1H3.
What are the key properties of 6-[2-(4-hydroxyphenyl)ethyl]-4-methylpyrano[3,2-c]pyridine-2,5-dione?
6-[2-(4-hydroxyphenyl)ethyl]-4-methylpyrano[3,2-c]pyridine-2,5-dione has a molecular weight of 297.31 g/mol, XLogP of 2.21, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(4-hydroxyphenyl)ethyl]-4-methylpyrano[3,2-c]pyridine-2,5-dione is sourced from PubChem (CID 135638868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).