2-[4-[[2-(5-chloroquinolin-8-yl)oxyacetyl]amino]phenoxy]acetamide

C19H16ClN3O4 — CID 55828463

IUPAC2-[4-[[2-(5-chloroquinolin-8-yl)oxyacetyl]amino]phenoxy]acetamide
SMILESNC(=O)COc1ccc(NC(=O)COc2ccc(Cl)c3cccnc23)cc1
InChIInChI=1S/C19H16ClN3O4/c20-15-7-8-16(19-14(15)2-1-9-22-19)27-11-18(25)23-12-3-5-13(6-4-12)26-10-17(21)24/h1-9H,10-11H2,(H2,21,24)(H,23,25)
InChIKeyBZVGAXXDZKGRSP-UHFFFAOYSA-N
MW385.81 g/mol
LogP2.77
Rot. Bonds7

About 2-[4-[[2-(5-chloroquinolin-8-yl)oxyacetyl]amino]phenoxy]acetamide

2-[4-[[2-(5-chloroquinolin-8-yl)oxyacetyl]amino]phenoxy]acetamide (PubChem CID 55828463) has the molecular formula C19H16ClN3O4 and a molecular weight of 385.81 g/mol. Its IUPAC name is 2-[4-[[2-(5-chloroquinolin-8-yl)oxyacetyl]amino]phenoxy]acetamide.

Molecular Properties

Compound Name2-[4-[[2-(5-chloroquinolin-8-yl)oxyacetyl]amino]phenoxy]acetamide
PubChem CID55828463
Molecular FormulaC19H16ClN3O4
Molecular Weight385.81 g/mol
Exact Mass385.08
IUPAC Name2-[4-[[2-(5-chloroquinolin-8-yl)oxyacetyl]amino]phenoxy]acetamide
SMILESNC(=O)COc1ccc(NC(=O)COc2ccc(Cl)c3cccnc23)cc1
InChIInChI=1S/C19H16ClN3O4/c20-15-7-8-16(19-14(15)2-1-9-22-19)27-11-18(25)23-12-3-5-13(6-4-12)26-10-17(21)24/h1-9H,10-11H2,(H2,21,24)(H,23,25)
InChIKeyBZVGAXXDZKGRSP-UHFFFAOYSA-N
XLogP2.77
TPSA103.54 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.81
LogP ≤ 52.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3-chloro-4-fluorophenyl)-2-(5-chloroquinolin-8-yl)oxyacetamide
CID 8716349
2-(5-chloroquinolin-8-yl)oxy-N-(3,5-dimethoxyphenyl)acetamide
CID 8005978
2-(5-chloroquinolin-8-yl)oxy-N-(3-methoxyphenyl)acetamide
CID 8716362
2-[[2-(5-chloroquinolin-8-yl)oxyacetyl]amino]-N-(4-fluorophenyl)acetamide
CID 8716441
2-(5-chloroquinolin-8-yl)oxy-N-(2,6-dimethylphenyl)acetamide
CID 8716363
2-[[2-(5-chloroquinolin-8-yl)oxyacetyl]amino]-3-methylpentanamide
CID 3865457
N-(5-chloro-2-fluorophenyl)-2-(5-chloroquinolin-8-yl)oxyacetamide
CID 8716254
2-(5-chloroquinolin-8-yl)oxyacetic acid;N-(3,4-dichlorophenyl)propanamide
CID 67383874
N-butan-2-yl-2-(5-chloroquinolin-8-yl)oxyacetamide
CID 47104754
N-(2-acetylphenyl)-2-(5-chloroquinolin-8-yl)oxyacetamide
CID 8716322
2-(5-chloroquinolin-8-yl)oxy-N-(2,3,4-trifluorophenyl)acetamide
CID 8716409
methyl 2-(5-chloroquinolin-8-yl)oxyacetate
CID 15257198

Frequently Asked Questions

What is the IUPAC name of 2-[4-[[2-(5-chloroquinolin-8-yl)oxyacetyl]amino]phenoxy]acetamide?
The IUPAC name of 2-[4-[[2-(5-chloroquinolin-8-yl)oxyacetyl]amino]phenoxy]acetamide (CID 55828463) is 2-[4-[[2-(5-chloroquinolin-8-yl)oxyacetyl]amino]phenoxy]acetamide.
What is the SMILES notation for 2-[4-[[2-(5-chloroquinolin-8-yl)oxyacetyl]amino]phenoxy]acetamide?
The canonical SMILES for 2-[4-[[2-(5-chloroquinolin-8-yl)oxyacetyl]amino]phenoxy]acetamide is NC(=O)COc1ccc(NC(=O)COc2ccc(Cl)c3cccnc23)cc1.
What is the InChIKey of 2-[4-[[2-(5-chloroquinolin-8-yl)oxyacetyl]amino]phenoxy]acetamide?
The InChIKey is BZVGAXXDZKGRSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16ClN3O4/c20-15-7-8-16(19-14(15)2-1-9-22-19)27-11-18(25)23-12-3-5-13(6-4-12)26-10-17(21)24/h1-9H,10-11H2,(H2,21,24)(H,23,25).
What are the key properties of 2-[4-[[2-(5-chloroquinolin-8-yl)oxyacetyl]amino]phenoxy]acetamide?
2-[4-[[2-(5-chloroquinolin-8-yl)oxyacetyl]amino]phenoxy]acetamide has a molecular weight of 385.81 g/mol, XLogP of 2.77, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[[2-(5-chloroquinolin-8-yl)oxyacetyl]amino]phenoxy]acetamide is sourced from PubChem (CID 55828463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).