3-(8-aminoquinolin-5-yl)oxybenzamide

C16H13N3O2 — CID 43449647

IUPAC3-(8-aminoquinolin-5-yl)oxybenzamide
SMILESNC(=O)c1cccc(Oc2ccc(N)c3ncccc23)c1
InChIInChI=1S/C16H13N3O2/c17-13-6-7-14(12-5-2-8-19-15(12)13)21-11-4-1-3-10(9-11)16(18)20/h1-9H,17H2,(H2,18,20)
InChIKeyZJSUMKXBOYLSEV-UHFFFAOYSA-N
MW279.30 g/mol
LogP2.71
Rot. Bonds3

About 3-(8-aminoquinolin-5-yl)oxybenzamide

3-(8-aminoquinolin-5-yl)oxybenzamide (PubChem CID 43449647) has the molecular formula C16H13N3O2 and a molecular weight of 279.30 g/mol. Its IUPAC name is 3-(8-aminoquinolin-5-yl)oxybenzamide.

Molecular Properties

Compound Name3-(8-aminoquinolin-5-yl)oxybenzamide
PubChem CID43449647
Molecular FormulaC16H13N3O2
Molecular Weight279.30 g/mol
Exact Mass279.10
IUPAC Name3-(8-aminoquinolin-5-yl)oxybenzamide
SMILESNC(=O)c1cccc(Oc2ccc(N)c3ncccc23)c1
InChIInChI=1S/C16H13N3O2/c17-13-6-7-14(12-5-2-8-19-15(12)13)21-11-4-1-3-10(9-11)16(18)20/h1-9H,17H2,(H2,18,20)
InChIKeyZJSUMKXBOYLSEV-UHFFFAOYSA-N
XLogP2.71
TPSA91.23 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.30
LogP ≤ 52.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

5-[(2-methyl-4-pyridinyl)oxy]quinolin-8-amine
CID 116525610
3-(8-aminoquinolin-4-yl)oxy-N-benzylbenzamide
CID 155779006
2-(8-aminoquinolin-5-yl)oxyacetamide
CID 116524742
5-(4-chlorophenoxy)quinolin-8-amine
CID 43449608
5-(4-bromo-3,5-dimethylphenoxy)quinolin-8-amine
CID 107722592
4-(3-methylphenoxy)quinolin-8-amine
CID 83061210
4-(3-bromophenoxy)quinolin-8-amine
CID 83060320
[3-(8-aminoquinolin-4-yl)oxyphenyl]methanol
CID 83060557
3-amino-4-quinolin-8-yloxybenzamide
CID 43448569
2-(3-carbamoylphenoxy)pyridine-3-carboxylic acid
CID 24704749
5-(3-bromo-5-fluorophenoxy)quinolin-8-amine
CID 81322073
5-(2,4,5-trichlorophenoxy)quinolin-8-amine
CID 43449630

Frequently Asked Questions

What is the IUPAC name of 3-(8-aminoquinolin-5-yl)oxybenzamide?
The IUPAC name of 3-(8-aminoquinolin-5-yl)oxybenzamide (CID 43449647) is 3-(8-aminoquinolin-5-yl)oxybenzamide.
What is the SMILES notation for 3-(8-aminoquinolin-5-yl)oxybenzamide?
The canonical SMILES for 3-(8-aminoquinolin-5-yl)oxybenzamide is NC(=O)c1cccc(Oc2ccc(N)c3ncccc23)c1.
What is the InChIKey of 3-(8-aminoquinolin-5-yl)oxybenzamide?
The InChIKey is ZJSUMKXBOYLSEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13N3O2/c17-13-6-7-14(12-5-2-8-19-15(12)13)21-11-4-1-3-10(9-11)16(18)20/h1-9H,17H2,(H2,18,20).
What are the key properties of 3-(8-aminoquinolin-5-yl)oxybenzamide?
3-(8-aminoquinolin-5-yl)oxybenzamide has a molecular weight of 279.30 g/mol, XLogP of 2.71, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(8-aminoquinolin-5-yl)oxybenzamide is sourced from PubChem (CID 43449647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).