5-chloro-N-(3-cyanophenyl)-2-hydroxybenzamide

C14H9ClN2O2 — CID 3747508

IUPAC5-chloro-N-(3-cyanophenyl)-2-hydroxybenzamide
SMILESN#Cc1cccc(NC(=O)c2cc(Cl)ccc2O)c1
InChIInChI=1S/C14H9ClN2O2/c15-10-4-5-13(18)12(7-10)14(19)17-11-3-1-2-9(6-11)8-16/h1-7,18H,(H,17,19)
InChIKeyMGTMVZVPLYCBNP-UHFFFAOYSA-N
MW272.69 g/mol
LogP3.17
Rot. Bonds2

About 5-chloro-N-(3-cyanophenyl)-2-hydroxybenzamide

5-chloro-N-(3-cyanophenyl)-2-hydroxybenzamide (PubChem CID 3747508) has the molecular formula C14H9ClN2O2 and a molecular weight of 272.69 g/mol. Its IUPAC name is 5-chloro-N-(3-cyanophenyl)-2-hydroxybenzamide.

Molecular Properties

Compound Name5-chloro-N-(3-cyanophenyl)-2-hydroxybenzamide
PubChem CID3747508
Molecular FormulaC14H9ClN2O2
Molecular Weight272.69 g/mol
Exact Mass272.04
IUPAC Name5-chloro-N-(3-cyanophenyl)-2-hydroxybenzamide
SMILESN#Cc1cccc(NC(=O)c2cc(Cl)ccc2O)c1
InChIInChI=1S/C14H9ClN2O2/c15-10-4-5-13(18)12(7-10)14(19)17-11-3-1-2-9(6-11)8-16/h1-7,18H,(H,17,19)
InChIKeyMGTMVZVPLYCBNP-UHFFFAOYSA-N
XLogP3.17
TPSA73.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.69
LogP ≤ 53.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(3-cyanophenyl)-2-hydroxybenzamide?
The IUPAC name of 5-chloro-N-(3-cyanophenyl)-2-hydroxybenzamide (CID 3747508) is 5-chloro-N-(3-cyanophenyl)-2-hydroxybenzamide.
What is the SMILES notation for 5-chloro-N-(3-cyanophenyl)-2-hydroxybenzamide?
The canonical SMILES for 5-chloro-N-(3-cyanophenyl)-2-hydroxybenzamide is N#Cc1cccc(NC(=O)c2cc(Cl)ccc2O)c1.
What is the InChIKey of 5-chloro-N-(3-cyanophenyl)-2-hydroxybenzamide?
The InChIKey is MGTMVZVPLYCBNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9ClN2O2/c15-10-4-5-13(18)12(7-10)14(19)17-11-3-1-2-9(6-11)8-16/h1-7,18H,(H,17,19).
What are the key properties of 5-chloro-N-(3-cyanophenyl)-2-hydroxybenzamide?
5-chloro-N-(3-cyanophenyl)-2-hydroxybenzamide has a molecular weight of 272.69 g/mol, XLogP of 3.17, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(3-cyanophenyl)-2-hydroxybenzamide is sourced from PubChem (CID 3747508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).