N-(2,5-dichlorophenyl)-2-ethoxy-2-quinolin-4-ylacetamide

C19H16Cl2N2O2 — CID 127037341

IUPACN-(2,5-dichlorophenyl)-2-ethoxy-2-quinolin-4-ylacetamide
SMILESCCOC(C(=O)Nc1cc(Cl)ccc1Cl)c1ccnc2ccccc12
InChIInChI=1S/C19H16Cl2N2O2/c1-2-25-18(14-9-10-22-16-6-4-3-5-13(14)16)19(24)23-17-11-12(20)7-8-15(17)21/h3-11,18H,2H2,1H3,(H,23,24)
InChIKeyYVQOWYFGZMBREF-UHFFFAOYSA-N
MW375.26 g/mol
LogP5.26
Rot. Bonds5

About N-(2,5-dichlorophenyl)-2-ethoxy-2-quinolin-4-ylacetamide

N-(2,5-dichlorophenyl)-2-ethoxy-2-quinolin-4-ylacetamide (PubChem CID 127037341) has the molecular formula C19H16Cl2N2O2 and a molecular weight of 375.26 g/mol. Its IUPAC name is N-(2,5-dichlorophenyl)-2-ethoxy-2-quinolin-4-ylacetamide.

Molecular Properties

Compound NameN-(2,5-dichlorophenyl)-2-ethoxy-2-quinolin-4-ylacetamide
PubChem CID127037341
Molecular FormulaC19H16Cl2N2O2
Molecular Weight375.26 g/mol
Exact Mass374.06
IUPAC NameN-(2,5-dichlorophenyl)-2-ethoxy-2-quinolin-4-ylacetamide
SMILESCCOC(C(=O)Nc1cc(Cl)ccc1Cl)c1ccnc2ccccc12
InChIInChI=1S/C19H16Cl2N2O2/c1-2-25-18(14-9-10-22-16-6-4-3-5-13(14)16)19(24)23-17-11-12(20)7-8-15(17)21/h3-11,18H,2H2,1H3,(H,23,24)
InChIKeyYVQOWYFGZMBREF-UHFFFAOYSA-N
XLogP5.26
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500375.26
LogP ≤ 55.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,4-dichlorophenyl)-2-ethoxy-N-quinolin-3-ylacetamide
CID 127036258
N-(2,5-dichlorophenyl)-2-quinazolin-4-ylsulfanylpropanamide
CID 42968881
N-(2,5-dichlorophenyl)-2-phenoxybutanamide
CID 2886435
[(2R)-1-(2,5-dichloroanilino)-1-oxopropan-2-yl] 2-methylquinoline-4-carboxylate
CID 7648331
N-[2-chloro-5-(propanoylamino)phenyl]quinoline-4-carboxamide
CID 171686511
1-(4-chloro-3-quinolin-4-ylphenyl)-3-(2,4-dichlorophenyl)urea
CID 70366700
N-(2,5-dichlorophenyl)-2-pyrimidin-2-ylsulfanylpropanamide
CID 18075928
N-(2,5-dichlorophenyl)-2-pyridin-2-ylsulfanylpropanamide
CID 16530287
(2R)-N-(2,5-dichlorophenyl)-2-phenoxypropanamide
CID 7723452
N-(2,5-dichlorophenyl)-N'-(2,6-diethylphenyl)oxamide
CID 108500926
(2S)-2-bromo-N-(2,5-dichlorophenyl)propanamide
CID 94831435
[2-(2,5-dichloroanilino)-2-oxoethyl]-[(1S)-1-naphthalen-1-ylethyl]azanium
CID 9397020

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dichlorophenyl)-2-ethoxy-2-quinolin-4-ylacetamide?
The IUPAC name of N-(2,5-dichlorophenyl)-2-ethoxy-2-quinolin-4-ylacetamide (CID 127037341) is N-(2,5-dichlorophenyl)-2-ethoxy-2-quinolin-4-ylacetamide.
What is the SMILES notation for N-(2,5-dichlorophenyl)-2-ethoxy-2-quinolin-4-ylacetamide?
The canonical SMILES for N-(2,5-dichlorophenyl)-2-ethoxy-2-quinolin-4-ylacetamide is CCOC(C(=O)Nc1cc(Cl)ccc1Cl)c1ccnc2ccccc12.
What is the InChIKey of N-(2,5-dichlorophenyl)-2-ethoxy-2-quinolin-4-ylacetamide?
The InChIKey is YVQOWYFGZMBREF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16Cl2N2O2/c1-2-25-18(14-9-10-22-16-6-4-3-5-13(14)16)19(24)23-17-11-12(20)7-8-15(17)21/h3-11,18H,2H2,1H3,(H,23,24).
What are the key properties of N-(2,5-dichlorophenyl)-2-ethoxy-2-quinolin-4-ylacetamide?
N-(2,5-dichlorophenyl)-2-ethoxy-2-quinolin-4-ylacetamide has a molecular weight of 375.26 g/mol, XLogP of 5.26, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dichlorophenyl)-2-ethoxy-2-quinolin-4-ylacetamide is sourced from PubChem (CID 127037341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).