N-[(4-chlorophenyl)methyl]-2-(5-chloroquinolin-8-yl)oxy-N-methylacetamide

C19H16Cl2N2O2 — CID 8716397

IUPACN-[(4-chlorophenyl)methyl]-2-(5-chloroquinolin-8-yl)oxy-N-methylacetamide
SMILESCN(Cc1ccc(Cl)cc1)C(=O)COc1ccc(Cl)c2cccnc12
InChIInChI=1S/C19H16Cl2N2O2/c1-23(11-13-4-6-14(20)7-5-13)18(24)12-25-17-9-8-16(21)15-3-2-10-22-19(15)17/h2-10H,11-12H2,1H3
InChIKeyHDZXXQPDWFJWIJ-UHFFFAOYSA-N
MW375.26 g/mol
LogP4.58
Rot. Bonds5

About N-[(4-chlorophenyl)methyl]-2-(5-chloroquinolin-8-yl)oxy-N-methylacetamide

N-[(4-chlorophenyl)methyl]-2-(5-chloroquinolin-8-yl)oxy-N-methylacetamide (PubChem CID 8716397) has the molecular formula C19H16Cl2N2O2 and a molecular weight of 375.26 g/mol. Its IUPAC name is N-[(4-chlorophenyl)methyl]-2-(5-chloroquinolin-8-yl)oxy-N-methylacetamide.

Molecular Properties

Compound NameN-[(4-chlorophenyl)methyl]-2-(5-chloroquinolin-8-yl)oxy-N-methylacetamide
PubChem CID8716397
Molecular FormulaC19H16Cl2N2O2
Molecular Weight375.26 g/mol
Exact Mass374.06
IUPAC NameN-[(4-chlorophenyl)methyl]-2-(5-chloroquinolin-8-yl)oxy-N-methylacetamide
SMILESCN(Cc1ccc(Cl)cc1)C(=O)COc1ccc(Cl)c2cccnc12
InChIInChI=1S/C19H16Cl2N2O2/c1-23(11-13-4-6-14(20)7-5-13)18(24)12-25-17-9-8-16(21)15-3-2-10-22-19(15)17/h2-10H,11-12H2,1H3
InChIKeyHDZXXQPDWFJWIJ-UHFFFAOYSA-N
XLogP4.58
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.26
LogP ≤ 54.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(5-chloroquinolin-8-yl)oxy-N-[(3-fluoro-4-methoxyphenyl)methyl]-N-methylacetamide
CID 51190547
2-(5-chloroquinolin-8-yl)oxy-N-methyl-N-[[2-(trifluoromethyl)phenyl]methyl]acetamide
CID 55824024
2-(5-chloroquinolin-8-yl)oxy-N-(2-cyanoethyl)-N-methylacetamide
CID 43243799
N-(3-amino-4-methylpentyl)-2-(5-chloroquinolin-8-yl)oxy-N-methylacetamide;dihydrochloride
CID 119657984
methyl 2-(5-chloroquinolin-8-yl)oxyacetate
CID 15257198
N-methyl-N-[(4-methylsulfanylphenyl)methyl]-2-quinolin-8-yloxyacetamide
CID 9453515
N-[(4-chlorophenyl)methyl]-2-(2-ethylphenoxy)-N-methylacetamide
CID 112778951
3-[[2-(5-chloroquinolin-8-yl)oxyacetyl]-ethylamino]propanoic acid
CID 120516814
N-[(1S)-1-(4-chlorophenyl)ethyl]-2-(5-chloroquinolin-8-yl)oxyacetamide
CID 8716466
propan-2-yl 2-(5-chloroquinolin-8-yl)oxyacetate
CID 19390515
2-(2,5-dichlorophenoxy)-N-methyl-N-[(4-methylphenyl)methyl]acetamide
CID 112774399
[2-[(4-chlorophenyl)methyl-methylamino]-2-oxoethyl] 2-methylsulfanylpyridine-3-carboxylate
CID 8765526

Frequently Asked Questions

What is the IUPAC name of N-[(4-chlorophenyl)methyl]-2-(5-chloroquinolin-8-yl)oxy-N-methylacetamide?
The IUPAC name of N-[(4-chlorophenyl)methyl]-2-(5-chloroquinolin-8-yl)oxy-N-methylacetamide (CID 8716397) is N-[(4-chlorophenyl)methyl]-2-(5-chloroquinolin-8-yl)oxy-N-methylacetamide.
What is the SMILES notation for N-[(4-chlorophenyl)methyl]-2-(5-chloroquinolin-8-yl)oxy-N-methylacetamide?
The canonical SMILES for N-[(4-chlorophenyl)methyl]-2-(5-chloroquinolin-8-yl)oxy-N-methylacetamide is CN(Cc1ccc(Cl)cc1)C(=O)COc1ccc(Cl)c2cccnc12.
What is the InChIKey of N-[(4-chlorophenyl)methyl]-2-(5-chloroquinolin-8-yl)oxy-N-methylacetamide?
The InChIKey is HDZXXQPDWFJWIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16Cl2N2O2/c1-23(11-13-4-6-14(20)7-5-13)18(24)12-25-17-9-8-16(21)15-3-2-10-22-19(15)17/h2-10H,11-12H2,1H3.
What are the key properties of N-[(4-chlorophenyl)methyl]-2-(5-chloroquinolin-8-yl)oxy-N-methylacetamide?
N-[(4-chlorophenyl)methyl]-2-(5-chloroquinolin-8-yl)oxy-N-methylacetamide has a molecular weight of 375.26 g/mol, XLogP of 4.58, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-chlorophenyl)methyl]-2-(5-chloroquinolin-8-yl)oxy-N-methylacetamide is sourced from PubChem (CID 8716397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).