1-(hydroxymethyl)-3-[(4-methoxyphenyl)methoxy]pyridin-4-one

C14H15NO4 — CID 154265521

IUPAC1-(hydroxymethyl)-3-[(4-methoxyphenyl)methoxy]pyridin-4-one
SMILESCOc1ccc(COc2cn(CO)ccc2=O)cc1
InChIInChI=1S/C14H15NO4/c1-18-12-4-2-11(3-5-12)9-19-14-8-15(10-16)7-6-13(14)17/h2-8,16H,9-10H2,1H3
InChIKeyVTZBPVWPDNSTPV-UHFFFAOYSA-N
MW261.28 g/mol
LogP1.39
Rot. Bonds5

About 1-(hydroxymethyl)-3-[(4-methoxyphenyl)methoxy]pyridin-4-one

1-(hydroxymethyl)-3-[(4-methoxyphenyl)methoxy]pyridin-4-one (PubChem CID 154265521) has the molecular formula C14H15NO4 and a molecular weight of 261.28 g/mol. Its IUPAC name is 1-(hydroxymethyl)-3-[(4-methoxyphenyl)methoxy]pyridin-4-one.

Molecular Properties

Compound Name1-(hydroxymethyl)-3-[(4-methoxyphenyl)methoxy]pyridin-4-one
PubChem CID154265521
Molecular FormulaC14H15NO4
Molecular Weight261.28 g/mol
Exact Mass261.10
IUPAC Name1-(hydroxymethyl)-3-[(4-methoxyphenyl)methoxy]pyridin-4-one
SMILESCOc1ccc(COc2cn(CO)ccc2=O)cc1
InChIInChI=1S/C14H15NO4/c1-18-12-4-2-11(3-5-12)9-19-14-8-15(10-16)7-6-13(14)17/h2-8,16H,9-10H2,1H3
InChIKeyVTZBPVWPDNSTPV-UHFFFAOYSA-N
XLogP1.39
TPSA60.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.28
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(dimethylamino)-2-(hydroxymethyl)-5-[(4-methoxyphenyl)methoxy]pyridin-4-one
CID 139662460
1,5-bis[(4-methoxyphenyl)methoxy]-4-oxopyridine-2-carboxylic acid
CID 70812490
[4-[(4-methoxyphenyl)methoxy]-3-methylsulfonylphenyl]methanol
CID 142526629
[8-[(4-methoxyphenyl)methoxy]imidazo[1,2-a]pyridin-2-yl]methanol
CID 70511743
(4-methoxyphenyl)methanol
CID 7738
1-(3-bromophenyl)-5-[(4-methoxyphenyl)methoxy]-4-oxopyridine-2-carbaldehyde
CID 86680277
methyl 3-bromo-4-[(4-methoxyphenyl)methoxy]benzoate
CID 171484206
1-methoxy-4-[(4-phenylmethoxyphenoxy)methyl]benzene
CID 12029541
(4-methoxyphenyl)methyl 3-bromo-4-[(4-methoxyphenyl)methoxy]benzoate
CID 142526842
3-bromo-4-[(4-methoxyphenyl)methoxy]thiophene
CID 152568718
2-bromo-1-methoxy-3-[(4-methoxyphenyl)methoxy]benzene
CID 142468991
1-[2,4-bis[(4-methoxyphenyl)methoxy]phenyl]ethanone
CID 11280801

Frequently Asked Questions

What is the IUPAC name of 1-(hydroxymethyl)-3-[(4-methoxyphenyl)methoxy]pyridin-4-one?
The IUPAC name of 1-(hydroxymethyl)-3-[(4-methoxyphenyl)methoxy]pyridin-4-one (CID 154265521) is 1-(hydroxymethyl)-3-[(4-methoxyphenyl)methoxy]pyridin-4-one.
What is the SMILES notation for 1-(hydroxymethyl)-3-[(4-methoxyphenyl)methoxy]pyridin-4-one?
The canonical SMILES for 1-(hydroxymethyl)-3-[(4-methoxyphenyl)methoxy]pyridin-4-one is COc1ccc(COc2cn(CO)ccc2=O)cc1.
What is the InChIKey of 1-(hydroxymethyl)-3-[(4-methoxyphenyl)methoxy]pyridin-4-one?
The InChIKey is VTZBPVWPDNSTPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO4/c1-18-12-4-2-11(3-5-12)9-19-14-8-15(10-16)7-6-13(14)17/h2-8,16H,9-10H2,1H3.
What are the key properties of 1-(hydroxymethyl)-3-[(4-methoxyphenyl)methoxy]pyridin-4-one?
1-(hydroxymethyl)-3-[(4-methoxyphenyl)methoxy]pyridin-4-one has a molecular weight of 261.28 g/mol, XLogP of 1.39, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(hydroxymethyl)-3-[(4-methoxyphenyl)methoxy]pyridin-4-one is sourced from PubChem (CID 154265521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).