2-[[2-(5,6,7,8-tetrahydroquinolin-4-yloxy)acetyl]amino]benzamide

C18H19N3O3 — CID 90640860

IUPAC2-[[2-(5,6,7,8-tetrahydroquinolin-4-yloxy)acetyl]amino]benzamide
SMILESNC(=O)c1ccccc1NC(=O)COc1ccnc2c1CCCC2
InChIInChI=1S/C18H19N3O3/c19-18(23)13-6-2-4-8-15(13)21-17(22)11-24-16-9-10-20-14-7-3-1-5-12(14)16/h2,4,6,8-10H,1,3,5,7,11H2,(H2,19,23)(H,21,22)
InChIKeyPBGRQFVIWBURKC-UHFFFAOYSA-N
MW325.37 g/mol
LogP2.08
Rot. Bonds5

About 2-[[2-(5,6,7,8-tetrahydroquinolin-4-yloxy)acetyl]amino]benzamide

2-[[2-(5,6,7,8-tetrahydroquinolin-4-yloxy)acetyl]amino]benzamide (PubChem CID 90640860) has the molecular formula C18H19N3O3 and a molecular weight of 325.37 g/mol. Its IUPAC name is 2-[[2-(5,6,7,8-tetrahydroquinolin-4-yloxy)acetyl]amino]benzamide.

Molecular Properties

Compound Name2-[[2-(5,6,7,8-tetrahydroquinolin-4-yloxy)acetyl]amino]benzamide
PubChem CID90640860
Molecular FormulaC18H19N3O3
Molecular Weight325.37 g/mol
Exact Mass325.14
IUPAC Name2-[[2-(5,6,7,8-tetrahydroquinolin-4-yloxy)acetyl]amino]benzamide
SMILESNC(=O)c1ccccc1NC(=O)COc1ccnc2c1CCCC2
InChIInChI=1S/C18H19N3O3/c19-18(23)13-6-2-4-8-15(13)21-17(22)11-24-16-9-10-20-14-7-3-1-5-12(14)16/h2,4,6,8-10H,1,3,5,7,11H2,(H2,19,23)(H,21,22)
InChIKeyPBGRQFVIWBURKC-UHFFFAOYSA-N
XLogP2.08
TPSA94.31 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.37
LogP ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-methylphenyl)-2-(5,6,7,8-tetrahydroquinolin-4-yloxy)acetamide
CID 90640820
2-[[2-(2-methylphenoxy)acetyl]amino]benzamide
CID 4268113
methyl 4-[[2-(5,6,7,8-tetrahydroquinolin-4-yloxy)acetyl]amino]benzoate
CID 90640857
N-(2-phenoxyethyl)-2-(5,6,7,8-tetrahydroquinolin-4-yloxy)acetamide
CID 90641018
N-(4-cyanophenyl)-2-(5,6,7,8-tetrahydroquinolin-4-yloxy)acetamide
CID 90641003
N-(4-nitrophenyl)-2-(5,6,7,8-tetrahydroquinolin-4-yloxy)acetamide
CID 90640835
N-(4-methylsulfonylphenyl)-2-(5,6,7,8-tetrahydroquinolin-4-yloxy)acetamide
CID 90641021
N-(2-methyl-5-nitrophenyl)-2-(5,6,7,8-tetrahydroquinolin-4-yloxy)acetamide
CID 90640899
2-(5,6,7,8-tetrahydroquinolin-4-yloxy)-N-[4-(tetrazol-1-yl)phenyl]acetamide
CID 90640680
2-[[2-(2-cyanophenoxy)acetyl]amino]benzamide
CID 7560509
N-butyl-2-(5,6,7,8-tetrahydroquinolin-4-yloxy)acetamide
CID 90640746
N-[(4-chlorophenyl)methyl]-2-(5,6,7,8-tetrahydroquinolin-4-yloxy)acetamide
CID 90640789

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(5,6,7,8-tetrahydroquinolin-4-yloxy)acetyl]amino]benzamide?
The IUPAC name of 2-[[2-(5,6,7,8-tetrahydroquinolin-4-yloxy)acetyl]amino]benzamide (CID 90640860) is 2-[[2-(5,6,7,8-tetrahydroquinolin-4-yloxy)acetyl]amino]benzamide.
What is the SMILES notation for 2-[[2-(5,6,7,8-tetrahydroquinolin-4-yloxy)acetyl]amino]benzamide?
The canonical SMILES for 2-[[2-(5,6,7,8-tetrahydroquinolin-4-yloxy)acetyl]amino]benzamide is NC(=O)c1ccccc1NC(=O)COc1ccnc2c1CCCC2.
What is the InChIKey of 2-[[2-(5,6,7,8-tetrahydroquinolin-4-yloxy)acetyl]amino]benzamide?
The InChIKey is PBGRQFVIWBURKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O3/c19-18(23)13-6-2-4-8-15(13)21-17(22)11-24-16-9-10-20-14-7-3-1-5-12(14)16/h2,4,6,8-10H,1,3,5,7,11H2,(H2,19,23)(H,21,22).
What are the key properties of 2-[[2-(5,6,7,8-tetrahydroquinolin-4-yloxy)acetyl]amino]benzamide?
2-[[2-(5,6,7,8-tetrahydroquinolin-4-yloxy)acetyl]amino]benzamide has a molecular weight of 325.37 g/mol, XLogP of 2.08, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(5,6,7,8-tetrahydroquinolin-4-yloxy)acetyl]amino]benzamide is sourced from PubChem (CID 90640860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).