N-(3,5-dichloro-4-hydroxyphenyl)-4-methoxybenzamide

C14H11Cl2NO3 — CID 1254136

IUPACN-(3,5-dichloro-4-hydroxyphenyl)-4-methoxybenzamide
SMILESCOc1ccc(C(=O)Nc2cc(Cl)c(O)c(Cl)c2)cc1
InChIInChI=1S/C14H11Cl2NO3/c1-20-10-4-2-8(3-5-10)14(19)17-9-6-11(15)13(18)12(16)7-9/h2-7,18H,1H3,(H,17,19)
InChIKeyPORGDLOVJFDZAX-UHFFFAOYSA-N
MW312.15 g/mol
LogP3.96
Rot. Bonds3

About N-(3,5-dichloro-4-hydroxyphenyl)-4-methoxybenzamide

N-(3,5-dichloro-4-hydroxyphenyl)-4-methoxybenzamide (PubChem CID 1254136) has the molecular formula C14H11Cl2NO3 and a molecular weight of 312.15 g/mol. Its IUPAC name is N-(3,5-dichloro-4-hydroxyphenyl)-4-methoxybenzamide.

Molecular Properties

Compound NameN-(3,5-dichloro-4-hydroxyphenyl)-4-methoxybenzamide
PubChem CID1254136
Molecular FormulaC14H11Cl2NO3
Molecular Weight312.15 g/mol
Exact Mass311.01
IUPAC NameN-(3,5-dichloro-4-hydroxyphenyl)-4-methoxybenzamide
SMILESCOc1ccc(C(=O)Nc2cc(Cl)c(O)c(Cl)c2)cc1
InChIInChI=1S/C14H11Cl2NO3/c1-20-10-4-2-8(3-5-10)14(19)17-9-6-11(15)13(18)12(16)7-9/h2-7,18H,1H3,(H,17,19)
InChIKeyPORGDLOVJFDZAX-UHFFFAOYSA-N
XLogP3.96
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.15
LogP ≤ 53.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroquinone', 'substructure': 'N/A'}

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Related Compounds

N-[3-chloro-5-[(4-methoxybenzoyl)amino]phenyl]-4-methoxybenzamide
CID 68786791
3-chloro-N-(3,5-dichloro-4-hydroxyphenyl)-4-methoxybenzamide
CID 2994955
4-chloro-N-(3,5-dichloro-4-hydroxyphenyl)benzamide
CID 5119664
3,4-dichloro-N-(3,5-dichloro-4-hydroxyphenyl)benzamide
CID 82885265
[4-[(3,5-dichloro-4-hydroxyphenyl)carbamoyl]-2-methoxyphenyl] acetate
CID 2993167
4-(chloromethyl)-N-(3,5-dichloro-4-hydroxyphenyl)benzamide
CID 107679537
4-methoxy-N-(3,4,5-trimethoxyphenyl)benzamide
CID 4198373
3-chloro-4-methoxy-N-(4-methoxyphenyl)benzamide
CID 44871411
N-(3,5-dimethylphenyl)-4-(4-methoxyphenoxy)benzamide
CID 16651159
N-(4-chlorophenyl)-4-(4-methoxyphenoxy)benzamide
CID 16651140
N-(4-amino-3,5-dichlorophenyl)-4-[(4-methoxyphenyl)sulfamoyl]benzamide
CID 24563955
ethyl 2-chloro-4-[(4-methoxybenzoyl)amino]benzoate
CID 92673889

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dichloro-4-hydroxyphenyl)-4-methoxybenzamide?
The IUPAC name of N-(3,5-dichloro-4-hydroxyphenyl)-4-methoxybenzamide (CID 1254136) is N-(3,5-dichloro-4-hydroxyphenyl)-4-methoxybenzamide.
What is the SMILES notation for N-(3,5-dichloro-4-hydroxyphenyl)-4-methoxybenzamide?
The canonical SMILES for N-(3,5-dichloro-4-hydroxyphenyl)-4-methoxybenzamide is COc1ccc(C(=O)Nc2cc(Cl)c(O)c(Cl)c2)cc1.
What is the InChIKey of N-(3,5-dichloro-4-hydroxyphenyl)-4-methoxybenzamide?
The InChIKey is PORGDLOVJFDZAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11Cl2NO3/c1-20-10-4-2-8(3-5-10)14(19)17-9-6-11(15)13(18)12(16)7-9/h2-7,18H,1H3,(H,17,19).
What are the key properties of N-(3,5-dichloro-4-hydroxyphenyl)-4-methoxybenzamide?
N-(3,5-dichloro-4-hydroxyphenyl)-4-methoxybenzamide has a molecular weight of 312.15 g/mol, XLogP of 3.96, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dichloro-4-hydroxyphenyl)-4-methoxybenzamide is sourced from PubChem (CID 1254136), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).