4-[[2-(hydroxymethyl)phenoxy]methyl]benzamide

C15H15NO3 — CID 103616898

IUPAC4-[[2-(hydroxymethyl)phenoxy]methyl]benzamide
SMILESNC(=O)c1ccc(COc2ccccc2CO)cc1
InChIInChI=1S/C15H15NO3/c16-15(18)12-7-5-11(6-8-12)10-19-14-4-2-1-3-13(14)9-17/h1-8,17H,9-10H2,(H2,16,18)
InChIKeyXIQADWQSDRYMCE-UHFFFAOYSA-N
MW257.29 g/mol
LogP1.86
Rot. Bonds5

About 4-[[2-(hydroxymethyl)phenoxy]methyl]benzamide

4-[[2-(hydroxymethyl)phenoxy]methyl]benzamide (PubChem CID 103616898) has the molecular formula C15H15NO3 and a molecular weight of 257.29 g/mol. Its IUPAC name is 4-[[2-(hydroxymethyl)phenoxy]methyl]benzamide.

Molecular Properties

Compound Name4-[[2-(hydroxymethyl)phenoxy]methyl]benzamide
PubChem CID103616898
Molecular FormulaC15H15NO3
Molecular Weight257.29 g/mol
Exact Mass257.11
IUPAC Name4-[[2-(hydroxymethyl)phenoxy]methyl]benzamide
SMILESNC(=O)c1ccc(COc2ccccc2CO)cc1
InChIInChI=1S/C15H15NO3/c16-15(18)12-7-5-11(6-8-12)10-19-14-4-2-1-3-13(14)9-17/h1-8,17H,9-10H2,(H2,16,18)
InChIKeyXIQADWQSDRYMCE-UHFFFAOYSA-N
XLogP1.86
TPSA72.55 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[[2-(hydroxymethyl)phenoxy]methyl]benzohydrazide
CID 63679637
4-[2-(hydroxymethyl)phenoxy]benzamide
CID 28946171
[2-[(4-methylphenyl)methoxy]phenyl]methanol
CID 887273
N-benzyl-2-[(4-carbamoylphenyl)methoxy]benzamide
CID 17465507
3-bromo-4-[2-(2-phenylmethoxyphenyl)ethyl]benzamide
CID 18974069
3-(hydroxymethyl)-4-phenylmethoxybenzoic acid
CID 90442233
2-[(4-carbamothioylphenyl)methoxy]benzamide
CID 24702610
4-[[2-(anilinomethyl)phenoxy]methyl]benzoic acid
CID 126125704
4-[(2-bromophenoxy)methyl]-N-(4-carbamoylphenyl)benzamide
CID 4617873
4-[[2-[[[3-(trifluoromethyl)phenyl]carbamoylamino]methyl]phenoxy]methyl]benzamide
CID 126669548
4-methoxy-3-phenylmethoxybenzamide
CID 22467475
2-[[2-(hydroxymethyl)phenoxy]methyl]benzohydrazide
CID 63680399

Frequently Asked Questions

What is the IUPAC name of 4-[[2-(hydroxymethyl)phenoxy]methyl]benzamide?
The IUPAC name of 4-[[2-(hydroxymethyl)phenoxy]methyl]benzamide (CID 103616898) is 4-[[2-(hydroxymethyl)phenoxy]methyl]benzamide.
What is the SMILES notation for 4-[[2-(hydroxymethyl)phenoxy]methyl]benzamide?
The canonical SMILES for 4-[[2-(hydroxymethyl)phenoxy]methyl]benzamide is NC(=O)c1ccc(COc2ccccc2CO)cc1.
What is the InChIKey of 4-[[2-(hydroxymethyl)phenoxy]methyl]benzamide?
The InChIKey is XIQADWQSDRYMCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO3/c16-15(18)12-7-5-11(6-8-12)10-19-14-4-2-1-3-13(14)9-17/h1-8,17H,9-10H2,(H2,16,18).
What are the key properties of 4-[[2-(hydroxymethyl)phenoxy]methyl]benzamide?
4-[[2-(hydroxymethyl)phenoxy]methyl]benzamide has a molecular weight of 257.29 g/mol, XLogP of 1.86, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[2-(hydroxymethyl)phenoxy]methyl]benzamide is sourced from PubChem (CID 103616898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).