2-chloro-N-[2-(2-ethoxyethoxy)phenyl]benzamide

C17H18ClNO3 — CID 17134034

IUPAC2-chloro-N-[2-(2-ethoxyethoxy)phenyl]benzamide
SMILESCCOCCOc1ccccc1NC(=O)c1ccccc1Cl
InChIInChI=1S/C17H18ClNO3/c1-2-21-11-12-22-16-10-6-5-9-15(16)19-17(20)13-7-3-4-8-14(13)18/h3-10H,2,11-12H2,1H3,(H,19,20)
InChIKeyACPVYQHNDSASJP-UHFFFAOYSA-N
MW319.79 g/mol
LogP4.01
Rot. Bonds7

About 2-chloro-N-[2-(2-ethoxyethoxy)phenyl]benzamide

2-chloro-N-[2-(2-ethoxyethoxy)phenyl]benzamide (PubChem CID 17134034) has the molecular formula C17H18ClNO3 and a molecular weight of 319.79 g/mol. Its IUPAC name is 2-chloro-N-[2-(2-ethoxyethoxy)phenyl]benzamide.

Molecular Properties

Compound Name2-chloro-N-[2-(2-ethoxyethoxy)phenyl]benzamide
PubChem CID17134034
Molecular FormulaC17H18ClNO3
Molecular Weight319.79 g/mol
Exact Mass319.10
IUPAC Name2-chloro-N-[2-(2-ethoxyethoxy)phenyl]benzamide
SMILESCCOCCOc1ccccc1NC(=O)c1ccccc1Cl
InChIInChI=1S/C17H18ClNO3/c1-2-21-11-12-22-16-10-6-5-9-15(16)19-17(20)13-7-3-4-8-14(13)18/h3-10H,2,11-12H2,1H3,(H,19,20)
InChIKeyACPVYQHNDSASJP-UHFFFAOYSA-N
XLogP4.01
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.79
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(2-ethoxyethoxy)phenyl]-2-nitrobenzamide
CID 17134030
2-(2-ethoxyethoxy)-N-(2-fluorophenyl)benzamide
CID 17122747
3-chloro-N-[2-(2-ethoxyethoxy)phenyl]benzamide
CID 17134086
N-(2-ethoxyphenyl)-2-(2-methoxyethoxy)benzamide
CID 15943045
2-chloro-N-[2-(2-methylpropoxy)phenyl]benzamide
CID 17074225
N-(2-chlorophenyl)-4-[2-[2-(2-ethoxyethoxy)benzoyl]hydrazinyl]-4-oxobutanamide
CID 17122868
N-[2-(2-chlorophenoxy)ethyl]-2-(2-ethoxyethoxy)aniline
CID 54801723
N-[2-(2-ethoxyethoxy)phenyl]pyridine-4-carboxamide
CID 17134093
N-(3-chloro-2-methylphenyl)-2-[2-(2-ethoxyethoxy)anilino]acetamide
CID 54827342
N-(2,3-dichlorophenyl)-2-[2-(2-ethoxyethoxy)anilino]acetamide
CID 54827691
N-[(3-chloro-2-methylphenyl)carbamothioyl]-2-(2-ethoxyethoxy)benzamide
CID 17122972
2-ethoxy-N-[2-(2-phenoxyethoxy)phenyl]benzamide
CID 17130918

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[2-(2-ethoxyethoxy)phenyl]benzamide?
The IUPAC name of 2-chloro-N-[2-(2-ethoxyethoxy)phenyl]benzamide (CID 17134034) is 2-chloro-N-[2-(2-ethoxyethoxy)phenyl]benzamide.
What is the SMILES notation for 2-chloro-N-[2-(2-ethoxyethoxy)phenyl]benzamide?
The canonical SMILES for 2-chloro-N-[2-(2-ethoxyethoxy)phenyl]benzamide is CCOCCOc1ccccc1NC(=O)c1ccccc1Cl.
What is the InChIKey of 2-chloro-N-[2-(2-ethoxyethoxy)phenyl]benzamide?
The InChIKey is ACPVYQHNDSASJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18ClNO3/c1-2-21-11-12-22-16-10-6-5-9-15(16)19-17(20)13-7-3-4-8-14(13)18/h3-10H,2,11-12H2,1H3,(H,19,20).
What are the key properties of 2-chloro-N-[2-(2-ethoxyethoxy)phenyl]benzamide?
2-chloro-N-[2-(2-ethoxyethoxy)phenyl]benzamide has a molecular weight of 319.79 g/mol, XLogP of 4.01, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[2-(2-ethoxyethoxy)phenyl]benzamide is sourced from PubChem (CID 17134034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).