2,5-dichloro-N-[2-[[2-(2-ethylphenoxy)acetyl]amino]ethyl]benzamide

C19H20Cl2N2O3 — CID 108542215

IUPAC2,5-dichloro-N-[2-[[2-(2-ethylphenoxy)acetyl]amino]ethyl]benzamide
SMILESCCc1ccccc1OCC(=O)NCCNC(=O)c1cc(Cl)ccc1Cl
InChIInChI=1S/C19H20Cl2N2O3/c1-2-13-5-3-4-6-17(13)26-12-18(24)22-9-10-23-19(25)15-11-14(20)7-8-16(15)21/h3-8,11H,2,9-10,12H2,1H3,(H,22,24)(H,23,25)
InChIKeyVWYVVPMTRVYIDC-UHFFFAOYSA-N
MW395.29 g/mol
LogP3.48
Rot. Bonds8

About 2,5-dichloro-N-[2-[[2-(2-ethylphenoxy)acetyl]amino]ethyl]benzamide

2,5-dichloro-N-[2-[[2-(2-ethylphenoxy)acetyl]amino]ethyl]benzamide (PubChem CID 108542215) has the molecular formula C19H20Cl2N2O3 and a molecular weight of 395.29 g/mol. Its IUPAC name is 2,5-dichloro-N-[2-[[2-(2-ethylphenoxy)acetyl]amino]ethyl]benzamide.

Molecular Properties

Compound Name2,5-dichloro-N-[2-[[2-(2-ethylphenoxy)acetyl]amino]ethyl]benzamide
PubChem CID108542215
Molecular FormulaC19H20Cl2N2O3
Molecular Weight395.29 g/mol
Exact Mass394.09
IUPAC Name2,5-dichloro-N-[2-[[2-(2-ethylphenoxy)acetyl]amino]ethyl]benzamide
SMILESCCc1ccccc1OCC(=O)NCCNC(=O)c1cc(Cl)ccc1Cl
InChIInChI=1S/C19H20Cl2N2O3/c1-2-13-5-3-4-6-17(13)26-12-18(24)22-9-10-23-19(25)15-11-14(20)7-8-16(15)21/h3-8,11H,2,9-10,12H2,1H3,(H,22,24)(H,23,25)
InChIKeyVWYVVPMTRVYIDC-UHFFFAOYSA-N
XLogP3.48
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.29
LogP ≤ 53.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

5-chloro-N-[2-[[2-(2-ethoxyphenoxy)acetyl]amino]ethyl]-2-methoxybenzamide
CID 108540827
2,5-dichloro-N-[2-[(2-methoxybenzoyl)amino]ethyl]benzamide
CID 108538079
2-chloro-N-[2-[[2-(2-ethylphenoxy)acetyl]amino]ethyl]propanamide
CID 108574553
2,5-dichloro-N-[2-[4-(2-methylphenoxy)butanoylamino]ethyl]benzamide
CID 108541813
2-chloro-N-[3-[2-[2-(2-ethylphenoxy)acetyl]hydrazinyl]-3-oxopropyl]-4-fluorobenzamide
CID 55786575
N-[2-[[2-(2-ethylphenoxy)acetyl]amino]ethyl]-3-methylbutanamide
CID 108538543
2-(2,5-dichlorophenoxy)-N-[2-(ethylamino)ethyl]acetamide;hydrochloride
CID 119504659
N'-(2-chloroacetyl)-2-(2-ethylphenoxy)acetohydrazide
CID 166414704
2,5-dichloro-N-[2-[(2-hydroxybenzoyl)amino]ethyl]benzamide
CID 108540057
2,5-dichloro-N-[2-(methylamino)ethyl]benzamide
CID 62659102
ethyl 4-[2-[(2,5-dichlorobenzoyl)amino]ethylamino]-4-oxobutanoate
CID 108573410
2-(2,5-dichlorophenoxy)-N-[(2-fluorophenyl)methyl]acetamide
CID 8578532

Frequently Asked Questions

What is the IUPAC name of 2,5-dichloro-N-[2-[[2-(2-ethylphenoxy)acetyl]amino]ethyl]benzamide?
The IUPAC name of 2,5-dichloro-N-[2-[[2-(2-ethylphenoxy)acetyl]amino]ethyl]benzamide (CID 108542215) is 2,5-dichloro-N-[2-[[2-(2-ethylphenoxy)acetyl]amino]ethyl]benzamide.
What is the SMILES notation for 2,5-dichloro-N-[2-[[2-(2-ethylphenoxy)acetyl]amino]ethyl]benzamide?
The canonical SMILES for 2,5-dichloro-N-[2-[[2-(2-ethylphenoxy)acetyl]amino]ethyl]benzamide is CCc1ccccc1OCC(=O)NCCNC(=O)c1cc(Cl)ccc1Cl.
What is the InChIKey of 2,5-dichloro-N-[2-[[2-(2-ethylphenoxy)acetyl]amino]ethyl]benzamide?
The InChIKey is VWYVVPMTRVYIDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20Cl2N2O3/c1-2-13-5-3-4-6-17(13)26-12-18(24)22-9-10-23-19(25)15-11-14(20)7-8-16(15)21/h3-8,11H,2,9-10,12H2,1H3,(H,22,24)(H,23,25).
What are the key properties of 2,5-dichloro-N-[2-[[2-(2-ethylphenoxy)acetyl]amino]ethyl]benzamide?
2,5-dichloro-N-[2-[[2-(2-ethylphenoxy)acetyl]amino]ethyl]benzamide has a molecular weight of 395.29 g/mol, XLogP of 3.48, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dichloro-N-[2-[[2-(2-ethylphenoxy)acetyl]amino]ethyl]benzamide is sourced from PubChem (CID 108542215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).