N-(4-chloro-3-hydroxyphenyl)-2,4-dimethylbenzamide

C15H14ClNO2 — CID 64788271

IUPACN-(4-chloro-3-hydroxyphenyl)-2,4-dimethylbenzamide
SMILESCc1ccc(C(=O)Nc2ccc(Cl)c(O)c2)c(C)c1
InChIInChI=1S/C15H14ClNO2/c1-9-3-5-12(10(2)7-9)15(19)17-11-4-6-13(16)14(18)8-11/h3-8,18H,1-2H3,(H,17,19)
InChIKeyINWJSNUYDPURAQ-UHFFFAOYSA-N
MW275.74 g/mol
LogP3.91
Rot. Bonds2

About N-(4-chloro-3-hydroxyphenyl)-2,4-dimethylbenzamide

N-(4-chloro-3-hydroxyphenyl)-2,4-dimethylbenzamide (PubChem CID 64788271) has the molecular formula C15H14ClNO2 and a molecular weight of 275.74 g/mol. Its IUPAC name is N-(4-chloro-3-hydroxyphenyl)-2,4-dimethylbenzamide.

Molecular Properties

Compound NameN-(4-chloro-3-hydroxyphenyl)-2,4-dimethylbenzamide
PubChem CID64788271
Molecular FormulaC15H14ClNO2
Molecular Weight275.74 g/mol
Exact Mass275.07
IUPAC NameN-(4-chloro-3-hydroxyphenyl)-2,4-dimethylbenzamide
SMILESCc1ccc(C(=O)Nc2ccc(Cl)c(O)c2)c(C)c1
InChIInChI=1S/C15H14ClNO2/c1-9-3-5-12(10(2)7-9)15(19)17-11-4-6-13(16)14(18)8-11/h3-8,18H,1-2H3,(H,17,19)
InChIKeyINWJSNUYDPURAQ-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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Related Compounds

N-(3,5-dichloro-4-hydroxyphenyl)-2,4-dimethylbenzamide
CID 82884847
N-(3-chloro-4-fluorophenyl)-2,4-dimethylbenzamide
CID 969420
N-(4-chloro-3-hydroxyphenyl)-3-hydroxy-2-methylbenzamide
CID 82829516
N-(4-chloro-3-fluorophenyl)-2-hydroxy-4-methylbenzamide
CID 60795096
2,5-dichloro-N-(4-chloro-3-hydroxyphenyl)benzamide
CID 64789245
N-(3,5-dimethylphenyl)-2,4-dimethylbenzamide
CID 925377
N-(2-chloro-4-methylphenyl)-2,4-dimethylbenzamide
CID 2557643
2-chloro-N-(3-fluoro-4-hydroxyphenyl)-4-methylbenzamide
CID 106861638
N-(4-tert-butylphenyl)-2,4-dimethylbenzamide
CID 953234
2-chloro-N-(4-chlorophenyl)-5-methylbenzamide
CID 122630204
3-chloro-N-(4-chloro-3-hydroxyphenyl)-4-hydroxybenzamide
CID 64788669
N-(4-chloro-3-hydroxyphenyl)-2-(4-methylphenyl)acetamide
CID 64787693

Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-3-hydroxyphenyl)-2,4-dimethylbenzamide?
The IUPAC name of N-(4-chloro-3-hydroxyphenyl)-2,4-dimethylbenzamide (CID 64788271) is N-(4-chloro-3-hydroxyphenyl)-2,4-dimethylbenzamide.
What is the SMILES notation for N-(4-chloro-3-hydroxyphenyl)-2,4-dimethylbenzamide?
The canonical SMILES for N-(4-chloro-3-hydroxyphenyl)-2,4-dimethylbenzamide is Cc1ccc(C(=O)Nc2ccc(Cl)c(O)c2)c(C)c1.
What is the InChIKey of N-(4-chloro-3-hydroxyphenyl)-2,4-dimethylbenzamide?
The InChIKey is INWJSNUYDPURAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClNO2/c1-9-3-5-12(10(2)7-9)15(19)17-11-4-6-13(16)14(18)8-11/h3-8,18H,1-2H3,(H,17,19).
What are the key properties of N-(4-chloro-3-hydroxyphenyl)-2,4-dimethylbenzamide?
N-(4-chloro-3-hydroxyphenyl)-2,4-dimethylbenzamide 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-(4-chloro-3-hydroxyphenyl)-2,4-dimethylbenzamide is sourced from PubChem (CID 64788271), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).