3-amino-4-quinolin-8-yloxybenzamide

C16H13N3O2 — CID 43448569

IUPAC3-amino-4-quinolin-8-yloxybenzamide
SMILESNC(=O)c1ccc(Oc2cccc3cccnc23)c(N)c1
InChIInChI=1S/C16H13N3O2/c17-12-9-11(16(18)20)6-7-13(12)21-14-5-1-3-10-4-2-8-19-15(10)14/h1-9H,17H2,(H2,18,20)
InChIKeyVPOIJFSUVDSRHQ-UHFFFAOYSA-N
MW279.30 g/mol
LogP2.71
Rot. Bonds3

About 3-amino-4-quinolin-8-yloxybenzamide

3-amino-4-quinolin-8-yloxybenzamide (PubChem CID 43448569) has the molecular formula C16H13N3O2 and a molecular weight of 279.30 g/mol. Its IUPAC name is 3-amino-4-quinolin-8-yloxybenzamide.

Molecular Properties

Compound Name3-amino-4-quinolin-8-yloxybenzamide
PubChem CID43448569
Molecular FormulaC16H13N3O2
Molecular Weight279.30 g/mol
Exact Mass279.10
IUPAC Name3-amino-4-quinolin-8-yloxybenzamide
SMILESNC(=O)c1ccc(Oc2cccc3cccnc23)c(N)c1
InChIInChI=1S/C16H13N3O2/c17-12-9-11(16(18)20)6-7-13(12)21-14-5-1-3-10-4-2-8-19-15(10)14/h1-9H,17H2,(H2,18,20)
InChIKeyVPOIJFSUVDSRHQ-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

3-amino-4-naphthalen-1-yloxybenzamide
CID 43448527
5-amino-6-quinolin-8-yloxypyridine-3-carboxylic acid
CID 81447216
1-(3-fluoro-4-quinolin-8-yloxyphenyl)ethanone
CID 28825225
3-amino-4-(2-chlorophenoxy)benzamide
CID 43382705
4-quinolin-8-yloxypyridin-3-amine
CID 28890445
4-quinolin-8-yloxybenzoic acid
CID 28825287
3-(8-aminoquinolin-5-yl)oxybenzamide
CID 43449647
5-amino-6-quinolin-8-yloxypyridine-2-carboxylic acid
CID 114408715
4-quinolin-8-yloxyquinolin-8-amine
CID 130319854
carbamoperoxoic acid;quinolin-8-ol
CID 175492056
3-amino-4-(2,4-dichlorophenoxy)benzamide
CID 43448525
2-methoxy-4-quinolin-8-yloxyaniline
CID 63678209

Frequently Asked Questions

What is the IUPAC name of 3-amino-4-quinolin-8-yloxybenzamide?
The IUPAC name of 3-amino-4-quinolin-8-yloxybenzamide (CID 43448569) is 3-amino-4-quinolin-8-yloxybenzamide.
What is the SMILES notation for 3-amino-4-quinolin-8-yloxybenzamide?
The canonical SMILES for 3-amino-4-quinolin-8-yloxybenzamide is NC(=O)c1ccc(Oc2cccc3cccnc23)c(N)c1.
What is the InChIKey of 3-amino-4-quinolin-8-yloxybenzamide?
The InChIKey is VPOIJFSUVDSRHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13N3O2/c17-12-9-11(16(18)20)6-7-13(12)21-14-5-1-3-10-4-2-8-19-15(10)14/h1-9H,17H2,(H2,18,20).
What are the key properties of 3-amino-4-quinolin-8-yloxybenzamide?
3-amino-4-quinolin-8-yloxybenzamide 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-amino-4-quinolin-8-yloxybenzamide is sourced from PubChem (CID 43448569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).