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

C20H16ClNO2 — CID 71381201

IUPACN-(3-benzylphenyl)-5-chloro-2-hydroxybenzamide
SMILESO=C(Nc1cccc(Cc2ccccc2)c1)c1cc(Cl)ccc1O
InChIInChI=1S/C20H16ClNO2/c21-16-9-10-19(23)18(13-16)20(24)22-17-8-4-7-15(12-17)11-14-5-2-1-3-6-14/h1-10,12-13,23H,11H2,(H,22,24)
InChIKeyQJGDSZDERQNQKQ-UHFFFAOYSA-N
MW337.81 g/mol
LogP4.89
Rot. Bonds4

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

N-(3-benzylphenyl)-5-chloro-2-hydroxybenzamide (PubChem CID 71381201) has the molecular formula C20H16ClNO2 and a molecular weight of 337.81 g/mol. Its IUPAC name is N-(3-benzylphenyl)-5-chloro-2-hydroxybenzamide.

Molecular Properties

Compound NameN-(3-benzylphenyl)-5-chloro-2-hydroxybenzamide
PubChem CID71381201
Molecular FormulaC20H16ClNO2
Molecular Weight337.81 g/mol
Exact Mass337.09
IUPAC NameN-(3-benzylphenyl)-5-chloro-2-hydroxybenzamide
SMILESO=C(Nc1cccc(Cc2ccccc2)c1)c1cc(Cl)ccc1O
InChIInChI=1S/C20H16ClNO2/c21-16-9-10-19(23)18(13-16)20(24)22-17-8-4-7-15(12-17)11-14-5-2-1-3-6-14/h1-10,12-13,23H,11H2,(H,22,24)
InChIKeyQJGDSZDERQNQKQ-UHFFFAOYSA-N
XLogP4.89
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.81
LogP ≤ 54.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(3-benzylphenyl)-5-chloro-2-hydroxybenzamide?
The IUPAC name of N-(3-benzylphenyl)-5-chloro-2-hydroxybenzamide (CID 71381201) is N-(3-benzylphenyl)-5-chloro-2-hydroxybenzamide.
What is the SMILES notation for N-(3-benzylphenyl)-5-chloro-2-hydroxybenzamide?
The canonical SMILES for N-(3-benzylphenyl)-5-chloro-2-hydroxybenzamide is O=C(Nc1cccc(Cc2ccccc2)c1)c1cc(Cl)ccc1O.
What is the InChIKey of N-(3-benzylphenyl)-5-chloro-2-hydroxybenzamide?
The InChIKey is QJGDSZDERQNQKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16ClNO2/c21-16-9-10-19(23)18(13-16)20(24)22-17-8-4-7-15(12-17)11-14-5-2-1-3-6-14/h1-10,12-13,23H,11H2,(H,22,24).
What are the key properties of N-(3-benzylphenyl)-5-chloro-2-hydroxybenzamide?
N-(3-benzylphenyl)-5-chloro-2-hydroxybenzamide has a molecular weight of 337.81 g/mol, XLogP of 4.89, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-benzylphenyl)-5-chloro-2-hydroxybenzamide is sourced from PubChem (CID 71381201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).