N-(3-chloro-4-methoxyphenyl)-2-(2-methoxyethoxy)benzamide

C17H18ClNO4 — CID 17355423

IUPACN-(3-chloro-4-methoxyphenyl)-2-(2-methoxyethoxy)benzamide
SMILESCOCCOc1ccccc1C(=O)Nc1ccc(OC)c(Cl)c1
InChIInChI=1S/C17H18ClNO4/c1-21-9-10-23-15-6-4-3-5-13(15)17(20)19-12-7-8-16(22-2)14(18)11-12/h3-8,11H,9-10H2,1-2H3,(H,19,20)
InChIKeyNAYAEGHXSUTEIO-UHFFFAOYSA-N
MW335.79 g/mol
LogP3.63
Rot. Bonds7

About N-(3-chloro-4-methoxyphenyl)-2-(2-methoxyethoxy)benzamide

N-(3-chloro-4-methoxyphenyl)-2-(2-methoxyethoxy)benzamide (PubChem CID 17355423) has the molecular formula C17H18ClNO4 and a molecular weight of 335.79 g/mol. Its IUPAC name is N-(3-chloro-4-methoxyphenyl)-2-(2-methoxyethoxy)benzamide.

Molecular Properties

Compound NameN-(3-chloro-4-methoxyphenyl)-2-(2-methoxyethoxy)benzamide
PubChem CID17355423
Molecular FormulaC17H18ClNO4
Molecular Weight335.79 g/mol
Exact Mass335.09
IUPAC NameN-(3-chloro-4-methoxyphenyl)-2-(2-methoxyethoxy)benzamide
SMILESCOCCOc1ccccc1C(=O)Nc1ccc(OC)c(Cl)c1
InChIInChI=1S/C17H18ClNO4/c1-21-9-10-23-15-6-4-3-5-13(15)17(20)19-12-7-8-16(22-2)14(18)11-12/h3-8,11H,9-10H2,1-2H3,(H,19,20)
InChIKeyNAYAEGHXSUTEIO-UHFFFAOYSA-N
XLogP3.63
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.79
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(3-chloro-4-methoxyphenyl)-2-(2-phenylethoxy)benzamide
CID 19628178
N-(3-chloro-4-methylphenyl)-2-(2-methoxyethoxy)benzamide
CID 17355384
N-(3-chloro-4-methoxyphenyl)-2-(2-methylpropoxy)benzamide
CID 4945530
N-(3-chloro-4-methoxyphenyl)-2-(phenoxymethyl)benzamide
CID 17428367
N-[4-[[3-chloro-4-(2-methoxyethoxy)phenyl]carbamothioylamino]phenyl]-2-fluorobenzamide
CID 10299114
N-(3,4-dimethoxyphenyl)-2-(3-methylbutoxy)benzamide
CID 54781407
N-(3,4-dimethylphenyl)-2-[[2-(2-methoxyethoxy)benzoyl]amino]benzamide
CID 17355422
N-[5-(3-chloro-4-methoxyanilino)-2-pyridinyl]-2-methoxybenzamide
CID 113033766
N-[2-[(3-chloro-4-methoxyphenyl)carbamoyl]phenyl]-3,4-dimethoxybenzamide
CID 2185661
N-[3-(2-methoxyethoxy)phenyl]-2-(2-phenoxyethoxy)benzamide
CID 17169883
N-(3-chloro-4-methoxyphenyl)-2-methoxy-3-methylbenzamide
CID 2993738
N-(2,5-dimethoxyphenyl)-2-(2-methoxyethoxy)benzamide
CID 17355355

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-4-methoxyphenyl)-2-(2-methoxyethoxy)benzamide?
The IUPAC name of N-(3-chloro-4-methoxyphenyl)-2-(2-methoxyethoxy)benzamide (CID 17355423) is N-(3-chloro-4-methoxyphenyl)-2-(2-methoxyethoxy)benzamide.
What is the SMILES notation for N-(3-chloro-4-methoxyphenyl)-2-(2-methoxyethoxy)benzamide?
The canonical SMILES for N-(3-chloro-4-methoxyphenyl)-2-(2-methoxyethoxy)benzamide is COCCOc1ccccc1C(=O)Nc1ccc(OC)c(Cl)c1.
What is the InChIKey of N-(3-chloro-4-methoxyphenyl)-2-(2-methoxyethoxy)benzamide?
The InChIKey is NAYAEGHXSUTEIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18ClNO4/c1-21-9-10-23-15-6-4-3-5-13(15)17(20)19-12-7-8-16(22-2)14(18)11-12/h3-8,11H,9-10H2,1-2H3,(H,19,20).
What are the key properties of N-(3-chloro-4-methoxyphenyl)-2-(2-methoxyethoxy)benzamide?
N-(3-chloro-4-methoxyphenyl)-2-(2-methoxyethoxy)benzamide has a molecular weight of 335.79 g/mol, XLogP of 3.63, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-4-methoxyphenyl)-2-(2-methoxyethoxy)benzamide is sourced from PubChem (CID 17355423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).