4-(hydroxymethyl)-N-phenylbenzamide

C14H13NO2 — CID 23181990

IUPAC4-(hydroxymethyl)-N-phenylbenzamide
SMILESO=C(Nc1ccccc1)c1ccc(CO)cc1
InChIInChI=1S/C14H13NO2/c16-10-11-6-8-12(9-7-11)14(17)15-13-4-2-1-3-5-13/h1-9,16H,10H2,(H,15,17)
InChIKeyUQVYFYDEGFRDKM-UHFFFAOYSA-N
MW227.26 g/mol
LogP2.43
Rot. Bonds3

About 4-(hydroxymethyl)-N-phenylbenzamide

4-(hydroxymethyl)-N-phenylbenzamide (PubChem CID 23181990) has the molecular formula C14H13NO2 and a molecular weight of 227.26 g/mol. Its IUPAC name is 4-(hydroxymethyl)-N-phenylbenzamide.

Molecular Properties

Compound Name4-(hydroxymethyl)-N-phenylbenzamide
PubChem CID23181990
Molecular FormulaC14H13NO2
Molecular Weight227.26 g/mol
Exact Mass227.09
IUPAC Name4-(hydroxymethyl)-N-phenylbenzamide
SMILESO=C(Nc1ccccc1)c1ccc(CO)cc1
InChIInChI=1S/C14H13NO2/c16-10-11-6-8-12(9-7-11)14(17)15-13-4-2-1-3-5-13/h1-9,16H,10H2,(H,15,17)
InChIKeyUQVYFYDEGFRDKM-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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Frequently Asked Questions

What is the IUPAC name of 4-(hydroxymethyl)-N-phenylbenzamide?
The IUPAC name of 4-(hydroxymethyl)-N-phenylbenzamide (CID 23181990) is 4-(hydroxymethyl)-N-phenylbenzamide.
What is the SMILES notation for 4-(hydroxymethyl)-N-phenylbenzamide?
The canonical SMILES for 4-(hydroxymethyl)-N-phenylbenzamide is O=C(Nc1ccccc1)c1ccc(CO)cc1.
What is the InChIKey of 4-(hydroxymethyl)-N-phenylbenzamide?
The InChIKey is UQVYFYDEGFRDKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13NO2/c16-10-11-6-8-12(9-7-11)14(17)15-13-4-2-1-3-5-13/h1-9,16H,10H2,(H,15,17).
What are the key properties of 4-(hydroxymethyl)-N-phenylbenzamide?
4-(hydroxymethyl)-N-phenylbenzamide 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 4-(hydroxymethyl)-N-phenylbenzamide is sourced from PubChem (CID 23181990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).