2-chloro-N-[2-[(3-chloro-2-pyridinyl)oxy]ethyl]benzamide

C14H12Cl2N2O2 — CID 74766924

IUPAC2-chloro-N-[2-[(3-chloro-2-pyridinyl)oxy]ethyl]benzamide
SMILESO=C(NCCOc1ncccc1Cl)c1ccccc1Cl
InChIInChI=1S/C14H12Cl2N2O2/c15-11-5-2-1-4-10(11)13(19)17-8-9-20-14-12(16)6-3-7-18-14/h1-7H,8-9H2,(H,17,19)
InChIKeyPGPCWWULOZLPKN-UHFFFAOYSA-N
MW311.17 g/mol
LogP3.20
Rot. Bonds5

About 2-chloro-N-[2-[(3-chloro-2-pyridinyl)oxy]ethyl]benzamide

2-chloro-N-[2-[(3-chloro-2-pyridinyl)oxy]ethyl]benzamide (PubChem CID 74766924) has the molecular formula C14H12Cl2N2O2 and a molecular weight of 311.17 g/mol. Its IUPAC name is 2-chloro-N-[2-[(3-chloro-2-pyridinyl)oxy]ethyl]benzamide.

Molecular Properties

Compound Name2-chloro-N-[2-[(3-chloro-2-pyridinyl)oxy]ethyl]benzamide
PubChem CID74766924
Molecular FormulaC14H12Cl2N2O2
Molecular Weight311.17 g/mol
Exact Mass310.03
IUPAC Name2-chloro-N-[2-[(3-chloro-2-pyridinyl)oxy]ethyl]benzamide
SMILESO=C(NCCOc1ncccc1Cl)c1ccccc1Cl
InChIInChI=1S/C14H12Cl2N2O2/c15-11-5-2-1-4-10(11)13(19)17-8-9-20-14-12(16)6-3-7-18-14/h1-7H,8-9H2,(H,17,19)
InChIKeyPGPCWWULOZLPKN-UHFFFAOYSA-N
XLogP3.20
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.17
LogP ≤ 53.20
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

1-amino-N-[2-[(3-chloro-2-pyridinyl)oxy]ethyl]cyclohexane-1-carboxamide
CID 119900722
2-chloro-N-(2-naphthalen-1-yloxyethyl)benzamide
CID 19174581
2-chloro-N-[2-(2-phenylphenoxy)ethyl]benzamide
CID 2994239
N-[2-(4-tert-butylphenoxy)ethyl]-2-chlorobenzamide
CID 27861720
2-chloro-N-[2-[(3-methyl-2-pyridin-2-ylbutanoyl)amino]ethyl]benzamide
CID 119039955
N-[2-[(3,5-dichloro-2-pyridinyl)oxy]ethyl]-2-(trifluoromethyl)benzamide
CID 74766847
N-[2-[(3-chloro-2-pyridinyl)oxy]ethyl]-4-ethylpiperazine-1-carboxamide
CID 75381167
N-[2-[(3-chloro-2-pyridinyl)oxy]ethyl]piperidine-3-carboxamide
CID 119900670
N-[2-[(3-chloro-2-pyridinyl)oxy]ethyl]-2-cyclopent-2-en-1-ylacetamide
CID 75380874
2-chloro-N-[2-oxo-2-(2-phenoxyethylamino)ethyl]benzamide
CID 26676807
2-chloro-N-(4-chlorobutyl)benzamide
CID 106845467
N-[2-[(3-chloro-2-pyridinyl)oxy]ethyl]-1-piperidin-4-yltriazole-4-carboxamide
CID 119900688

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[2-[(3-chloro-2-pyridinyl)oxy]ethyl]benzamide?
The IUPAC name of 2-chloro-N-[2-[(3-chloro-2-pyridinyl)oxy]ethyl]benzamide (CID 74766924) is 2-chloro-N-[2-[(3-chloro-2-pyridinyl)oxy]ethyl]benzamide.
What is the SMILES notation for 2-chloro-N-[2-[(3-chloro-2-pyridinyl)oxy]ethyl]benzamide?
The canonical SMILES for 2-chloro-N-[2-[(3-chloro-2-pyridinyl)oxy]ethyl]benzamide is O=C(NCCOc1ncccc1Cl)c1ccccc1Cl.
What is the InChIKey of 2-chloro-N-[2-[(3-chloro-2-pyridinyl)oxy]ethyl]benzamide?
The InChIKey is PGPCWWULOZLPKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12Cl2N2O2/c15-11-5-2-1-4-10(11)13(19)17-8-9-20-14-12(16)6-3-7-18-14/h1-7H,8-9H2,(H,17,19).
What are the key properties of 2-chloro-N-[2-[(3-chloro-2-pyridinyl)oxy]ethyl]benzamide?
2-chloro-N-[2-[(3-chloro-2-pyridinyl)oxy]ethyl]benzamide has a molecular weight of 311.17 g/mol, XLogP of 3.20, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[2-[(3-chloro-2-pyridinyl)oxy]ethyl]benzamide is sourced from PubChem (CID 74766924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).