N-(2-chloro-6-methylphenyl)-4-hydroxy-2-methylbenzamide

C15H14ClNO2 — CID 103865613

IUPACN-(2-chloro-6-methylphenyl)-4-hydroxy-2-methylbenzamide
SMILESCc1cc(O)ccc1C(=O)Nc1c(C)cccc1Cl
InChIInChI=1S/C15H14ClNO2/c1-9-4-3-5-13(16)14(9)17-15(19)12-7-6-11(18)8-10(12)2/h3-8,18H,1-2H3,(H,17,19)
InChIKeyQMXJSCKVSLCSQF-UHFFFAOYSA-N
MW275.74 g/mol
LogP3.91
Rot. Bonds2

About N-(2-chloro-6-methylphenyl)-4-hydroxy-2-methylbenzamide

N-(2-chloro-6-methylphenyl)-4-hydroxy-2-methylbenzamide (PubChem CID 103865613) has the molecular formula C15H14ClNO2 and a molecular weight of 275.74 g/mol. Its IUPAC name is N-(2-chloro-6-methylphenyl)-4-hydroxy-2-methylbenzamide.

Molecular Properties

Compound NameN-(2-chloro-6-methylphenyl)-4-hydroxy-2-methylbenzamide
PubChem CID103865613
Molecular FormulaC15H14ClNO2
Molecular Weight275.74 g/mol
Exact Mass275.07
IUPAC NameN-(2-chloro-6-methylphenyl)-4-hydroxy-2-methylbenzamide
SMILESCc1cc(O)ccc1C(=O)Nc1c(C)cccc1Cl
InChIInChI=1S/C15H14ClNO2/c1-9-4-3-5-13(16)14(9)17-15(19)12-7-6-11(18)8-10(12)2/h3-8,18H,1-2H3,(H,17,19)
InChIKeyQMXJSCKVSLCSQF-UHFFFAOYSA-N
XLogP3.91
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.74
LogP ≤ 53.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-6-methylphenyl)-4-hydroxy-2-methylbenzamide?
The IUPAC name of N-(2-chloro-6-methylphenyl)-4-hydroxy-2-methylbenzamide (CID 103865613) is N-(2-chloro-6-methylphenyl)-4-hydroxy-2-methylbenzamide.
What is the SMILES notation for N-(2-chloro-6-methylphenyl)-4-hydroxy-2-methylbenzamide?
The canonical SMILES for N-(2-chloro-6-methylphenyl)-4-hydroxy-2-methylbenzamide is Cc1cc(O)ccc1C(=O)Nc1c(C)cccc1Cl.
What is the InChIKey of N-(2-chloro-6-methylphenyl)-4-hydroxy-2-methylbenzamide?
The InChIKey is QMXJSCKVSLCSQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClNO2/c1-9-4-3-5-13(16)14(9)17-15(19)12-7-6-11(18)8-10(12)2/h3-8,18H,1-2H3,(H,17,19).
What are the key properties of N-(2-chloro-6-methylphenyl)-4-hydroxy-2-methylbenzamide?
N-(2-chloro-6-methylphenyl)-4-hydroxy-2-methylbenzamide has a molecular weight of 275.74 g/mol, XLogP of 3.91, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-6-methylphenyl)-4-hydroxy-2-methylbenzamide is sourced from PubChem (CID 103865613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).