4-(hydroxymethyl)-N-(2-hydroxy-1-phenylethyl)benzamide

C16H17NO3 — CID 63182295

IUPAC4-(hydroxymethyl)-N-(2-hydroxy-1-phenylethyl)benzamide
SMILESO=C(NC(CO)c1ccccc1)c1ccc(CO)cc1
InChIInChI=1S/C16H17NO3/c18-10-12-6-8-14(9-7-12)16(20)17-15(11-19)13-4-2-1-3-5-13/h1-9,15,18-19H,10-11H2,(H,17,20)
InChIKeyFAGLAAGGAUELJE-UHFFFAOYSA-N
MW271.32 g/mol
LogP1.64
Rot. Bonds5

About 4-(hydroxymethyl)-N-(2-hydroxy-1-phenylethyl)benzamide

4-(hydroxymethyl)-N-(2-hydroxy-1-phenylethyl)benzamide (PubChem CID 63182295) has the molecular formula C16H17NO3 and a molecular weight of 271.32 g/mol. Its IUPAC name is 4-(hydroxymethyl)-N-(2-hydroxy-1-phenylethyl)benzamide.

Molecular Properties

Compound Name4-(hydroxymethyl)-N-(2-hydroxy-1-phenylethyl)benzamide
PubChem CID63182295
Molecular FormulaC16H17NO3
Molecular Weight271.32 g/mol
Exact Mass271.12
IUPAC Name4-(hydroxymethyl)-N-(2-hydroxy-1-phenylethyl)benzamide
SMILESO=C(NC(CO)c1ccccc1)c1ccc(CO)cc1
InChIInChI=1S/C16H17NO3/c18-10-12-6-8-14(9-7-12)16(20)17-15(11-19)13-4-2-1-3-5-13/h1-9,15,18-19H,10-11H2,(H,17,20)
InChIKeyFAGLAAGGAUELJE-UHFFFAOYSA-N
XLogP1.64
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 51.64
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-hydroxy-1-phenylethyl)benzamide
CID 14150746
4-ethyl-N-[(1S)-2-hydroxy-1-phenylethyl]benzamide
CID 103945042
N-(2-hydroxy-1-phenylethyl)benzamide;hydrochloride
CID 175746997
4-N-(2-hydroxy-1-phenylethyl)benzene-1,4-dicarboxamide
CID 63182176
4-fluoro-N-(2-hydroxy-1-phenylethyl)benzamide
CID 63184399
4-chloro-N-[(1S)-2-hydroxy-1-phenylethyl]benzamide
CID 1480121
1-N,3-N,5-N-tris(2-hydroxy-1-phenylethyl)benzene-1,3,5-tricarboxamide
CID 139248401
1-N,3-N-bis[(1S)-2-hydroxy-1-phenylethyl]benzene-1,3-dicarboxamide
CID 71413066
N-(2-hydroxy-1-phenylethyl)-4-(pyrazol-1-ylmethyl)benzamide
CID 110001285
3,4-dihydroxy-N-(2-hydroxy-1-phenylethyl)benzamide
CID 103958252
1-N,4-N-bis(1-phenylpropyl)benzene-1,4-dicarboxamide
CID 43912072
N-[(1R)-2-hydroxy-1-phenylethyl]furan-3-carboxamide
CID 113258885

Frequently Asked Questions

What is the IUPAC name of 4-(hydroxymethyl)-N-(2-hydroxy-1-phenylethyl)benzamide?
The IUPAC name of 4-(hydroxymethyl)-N-(2-hydroxy-1-phenylethyl)benzamide (CID 63182295) is 4-(hydroxymethyl)-N-(2-hydroxy-1-phenylethyl)benzamide.
What is the SMILES notation for 4-(hydroxymethyl)-N-(2-hydroxy-1-phenylethyl)benzamide?
The canonical SMILES for 4-(hydroxymethyl)-N-(2-hydroxy-1-phenylethyl)benzamide is O=C(NC(CO)c1ccccc1)c1ccc(CO)cc1.
What is the InChIKey of 4-(hydroxymethyl)-N-(2-hydroxy-1-phenylethyl)benzamide?
The InChIKey is FAGLAAGGAUELJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO3/c18-10-12-6-8-14(9-7-12)16(20)17-15(11-19)13-4-2-1-3-5-13/h1-9,15,18-19H,10-11H2,(H,17,20).
What are the key properties of 4-(hydroxymethyl)-N-(2-hydroxy-1-phenylethyl)benzamide?
4-(hydroxymethyl)-N-(2-hydroxy-1-phenylethyl)benzamide has a molecular weight of 271.32 g/mol, XLogP of 1.64, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(hydroxymethyl)-N-(2-hydroxy-1-phenylethyl)benzamide is sourced from PubChem (CID 63182295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).