N-[3-(hydroxymethyl)phenyl]benzamide

C14H13NO2 — CID 9300318

IUPACN-[3-(hydroxymethyl)phenyl]benzamide
SMILESO=C(Nc1cccc(CO)c1)c1ccccc1
InChIInChI=1S/C14H13NO2/c16-10-11-5-4-8-13(9-11)15-14(17)12-6-2-1-3-7-12/h1-9,16H,10H2,(H,15,17)
InChIKeyQSLDWTSTSNGXQT-UHFFFAOYSA-N
MW227.26 g/mol
LogP2.43
Rot. Bonds3

About N-[3-(hydroxymethyl)phenyl]benzamide

N-[3-(hydroxymethyl)phenyl]benzamide (PubChem CID 9300318) has the molecular formula C14H13NO2 and a molecular weight of 227.26 g/mol. Its IUPAC name is N-[3-(hydroxymethyl)phenyl]benzamide.

Molecular Properties

Compound NameN-[3-(hydroxymethyl)phenyl]benzamide
PubChem CID9300318
Molecular FormulaC14H13NO2
Molecular Weight227.26 g/mol
Exact Mass227.09
IUPAC NameN-[3-(hydroxymethyl)phenyl]benzamide
SMILESO=C(Nc1cccc(CO)c1)c1ccccc1
InChIInChI=1S/C14H13NO2/c16-10-11-5-4-8-13(9-11)15-14(17)12-6-2-1-3-7-12/h1-9,16H,10H2,(H,15,17)
InChIKeyQSLDWTSTSNGXQT-UHFFFAOYSA-N
XLogP2.43
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.26
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

CID 3739
CID 3739
CID 4386
CID 4386
CID 6971
CID 6971
CID 19266
CID 19266
CID 6872
CID 6872
CID 78458
CID 78458
CID 68482
CID 68482
CID 5091716
CID 5091716
CID 11371
CID 11371
CID 6821
CID 6821
CID 85472
CID 85472
CID 48847
CID 48847

Frequently Asked Questions

What is the IUPAC name of N-[3-(hydroxymethyl)phenyl]benzamide?
The IUPAC name of N-[3-(hydroxymethyl)phenyl]benzamide (CID 9300318) is N-[3-(hydroxymethyl)phenyl]benzamide.
What is the SMILES notation for N-[3-(hydroxymethyl)phenyl]benzamide?
The canonical SMILES for N-[3-(hydroxymethyl)phenyl]benzamide is O=C(Nc1cccc(CO)c1)c1ccccc1.
What is the InChIKey of N-[3-(hydroxymethyl)phenyl]benzamide?
The InChIKey is QSLDWTSTSNGXQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13NO2/c16-10-11-5-4-8-13(9-11)15-14(17)12-6-2-1-3-7-12/h1-9,16H,10H2,(H,15,17).
What are the key properties of N-[3-(hydroxymethyl)phenyl]benzamide?
N-[3-(hydroxymethyl)phenyl]benzamide has a molecular weight of 227.26 g/mol, XLogP of 2.43, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(hydroxymethyl)phenyl]benzamide is sourced from PubChem (CID 9300318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).