3,5-dichloro-N-[3-(hydroxymethyl)phenyl]benzamide

C14H11Cl2NO2 — CID 60629922

IUPAC3,5-dichloro-N-[3-(hydroxymethyl)phenyl]benzamide
SMILESO=C(Nc1cccc(CO)c1)c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C14H11Cl2NO2/c15-11-5-10(6-12(16)7-11)14(19)17-13-3-1-2-9(4-13)8-18/h1-7,18H,8H2,(H,17,19)
InChIKeyJZVUWWIJDVQONC-UHFFFAOYSA-N
MW296.15 g/mol
LogP3.74
Rot. Bonds3

About 3,5-dichloro-N-[3-(hydroxymethyl)phenyl]benzamide

3,5-dichloro-N-[3-(hydroxymethyl)phenyl]benzamide (PubChem CID 60629922) has the molecular formula C14H11Cl2NO2 and a molecular weight of 296.15 g/mol. Its IUPAC name is 3,5-dichloro-N-[3-(hydroxymethyl)phenyl]benzamide.

Molecular Properties

Compound Name3,5-dichloro-N-[3-(hydroxymethyl)phenyl]benzamide
PubChem CID60629922
Molecular FormulaC14H11Cl2NO2
Molecular Weight296.15 g/mol
Exact Mass295.02
IUPAC Name3,5-dichloro-N-[3-(hydroxymethyl)phenyl]benzamide
SMILESO=C(Nc1cccc(CO)c1)c1cc(Cl)cc(Cl)c1
InChIInChI=1S/C14H11Cl2NO2/c15-11-5-10(6-12(16)7-11)14(19)17-13-3-1-2-9(4-13)8-18/h1-7,18H,8H2,(H,17,19)
InChIKeyJZVUWWIJDVQONC-UHFFFAOYSA-N
XLogP3.74
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.15
LogP ≤ 53.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[3-(bromomethyl)phenyl]-3,5-dichlorobenzamide
CID 77231175
1-(3-chlorophenyl)-3-[3-(hydroxymethyl)phenyl]urea
CID 60676894
3,5-dichloro-N-[3-(hydroxymethyl)phenyl]-2-iodobenzamide
CID 60630083
4-chloro-2-hydroxy-N-[3-(hydroxymethyl)phenyl]benzamide
CID 60715835
3-bromo-N-[3-(hydroxymethyl)phenyl]-5-methylbenzamide
CID 104852214
3-chloro-N-[2-[3-(hydroxymethyl)anilino]-2-oxoethyl]benzamide
CID 47005544
3,5-dichloro-N-[3-(phenylcarbamoylamino)phenyl]benzamide
CID 10971378
2-hydroxy-N-[3-(hydroxymethyl)phenyl]-6-oxo-1H-pyridine-4-carboxamide
CID 54897744
2,5-dichloro-N-[3-(hydroxymethyl)phenyl]thiophene-3-carboxamide
CID 103605214
3-[(3-chlorophenyl)sulfamoyl]-N-[3-(hydroxymethyl)phenyl]benzamide
CID 9300326
4-chloro-N-[3-(hydroxymethyl)phenyl]-3-nitrobenzamide
CID 60630033
3,5-dichloro-N-[3-(2-methylpropanoylamino)phenyl]benzamide
CID 17189296

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-N-[3-(hydroxymethyl)phenyl]benzamide?
The IUPAC name of 3,5-dichloro-N-[3-(hydroxymethyl)phenyl]benzamide (CID 60629922) is 3,5-dichloro-N-[3-(hydroxymethyl)phenyl]benzamide.
What is the SMILES notation for 3,5-dichloro-N-[3-(hydroxymethyl)phenyl]benzamide?
The canonical SMILES for 3,5-dichloro-N-[3-(hydroxymethyl)phenyl]benzamide is O=C(Nc1cccc(CO)c1)c1cc(Cl)cc(Cl)c1.
What is the InChIKey of 3,5-dichloro-N-[3-(hydroxymethyl)phenyl]benzamide?
The InChIKey is JZVUWWIJDVQONC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11Cl2NO2/c15-11-5-10(6-12(16)7-11)14(19)17-13-3-1-2-9(4-13)8-18/h1-7,18H,8H2,(H,17,19).
What are the key properties of 3,5-dichloro-N-[3-(hydroxymethyl)phenyl]benzamide?
3,5-dichloro-N-[3-(hydroxymethyl)phenyl]benzamide has a molecular weight of 296.15 g/mol, XLogP of 3.74, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-N-[3-(hydroxymethyl)phenyl]benzamide is sourced from PubChem (CID 60629922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).