N-benzyl-8-hydroxyquinoline-2-carboxamide

C17H14N2O2 — CID 46364206

IUPACN-benzyl-8-hydroxyquinoline-2-carboxamide
SMILESO=C(NCc1ccccc1)c1ccc2cccc(O)c2n1
InChIInChI=1S/C17H14N2O2/c20-15-8-4-7-13-9-10-14(19-16(13)15)17(21)18-11-12-5-2-1-3-6-12/h1-10,20H,11H2,(H,18,21)
InChIKeyXQUSIBIAOQEPHY-UHFFFAOYSA-N
MW278.31 g/mol
LogP2.87
Rot. Bonds3

About N-benzyl-8-hydroxyquinoline-2-carboxamide

N-benzyl-8-hydroxyquinoline-2-carboxamide (PubChem CID 46364206) has the molecular formula C17H14N2O2 and a molecular weight of 278.31 g/mol. Its IUPAC name is N-benzyl-8-hydroxyquinoline-2-carboxamide.

Molecular Properties

Compound NameN-benzyl-8-hydroxyquinoline-2-carboxamide
PubChem CID46364206
Molecular FormulaC17H14N2O2
Molecular Weight278.31 g/mol
Exact Mass278.11
IUPAC NameN-benzyl-8-hydroxyquinoline-2-carboxamide
SMILESO=C(NCc1ccccc1)c1ccc2cccc(O)c2n1
InChIInChI=1S/C17H14N2O2/c20-15-8-4-7-13-9-10-14(19-16(13)15)17(21)18-11-12-5-2-1-3-6-12/h1-10,20H,11H2,(H,18,21)
InChIKeyXQUSIBIAOQEPHY-UHFFFAOYSA-N
XLogP2.87
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.31
LogP ≤ 52.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2-chlorophenyl)methyl]-8-hydroxyquinoline-2-carboxamide
CID 46364203
N-benzyl-[1]benzofuro[3,2-b]pyridine-2-carboxamide
CID 69090493
6-amino-N-benzylpyridine-2-carboxamide
CID 62240949
copper;bis(8-hydroxyquinoline-2-carboxylic acid)
CID 172842653
N-benzyl-6-(chloromethyl)pyridine-2-carboxamide
CID 67806614
N-[[4-(hydroxymethyl)phenyl]methyl]quinoline-2-carboxamide
CID 68840052
2-N-benzyl-6-N-(2-methylpropyl)pyridine-2,6-dicarboxamide
CID 109094402
N-benzyl-6,7-dihydroxyisoquinoline-3-carboxamide
CID 135408977
2-N-benzyl-6-N-[(2-methylphenyl)methyl]pyridine-2,6-dicarboxamide
CID 109097211
1-(8-hydroxyquinolin-2-yl)ethanone
CID 19067452
N-(4-chlorophenyl)-8-hydroxyquinoline-2-carboxamide
CID 122182106
N-[(4-sulfamoylphenyl)methyl]quinoline-2-carboxamide
CID 4785409

Frequently Asked Questions

What is the IUPAC name of N-benzyl-8-hydroxyquinoline-2-carboxamide?
The IUPAC name of N-benzyl-8-hydroxyquinoline-2-carboxamide (CID 46364206) is N-benzyl-8-hydroxyquinoline-2-carboxamide.
What is the SMILES notation for N-benzyl-8-hydroxyquinoline-2-carboxamide?
The canonical SMILES for N-benzyl-8-hydroxyquinoline-2-carboxamide is O=C(NCc1ccccc1)c1ccc2cccc(O)c2n1.
What is the InChIKey of N-benzyl-8-hydroxyquinoline-2-carboxamide?
The InChIKey is XQUSIBIAOQEPHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N2O2/c20-15-8-4-7-13-9-10-14(19-16(13)15)17(21)18-11-12-5-2-1-3-6-12/h1-10,20H,11H2,(H,18,21).
What are the key properties of N-benzyl-8-hydroxyquinoline-2-carboxamide?
N-benzyl-8-hydroxyquinoline-2-carboxamide has a molecular weight of 278.31 g/mol, XLogP of 2.87, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-8-hydroxyquinoline-2-carboxamide is sourced from PubChem (CID 46364206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).