N-(2,3-dichlorophenyl)-4-hydroxy-2-oxo-1H-quinoline-3-carboxamide

C16H10Cl2N2O3 — CID 54677085

IUPACN-(2,3-dichlorophenyl)-4-hydroxy-2-oxo-1H-quinoline-3-carboxamide
SMILESO=C(Nc1cccc(Cl)c1Cl)c1c(O)c2ccccc2[nH]c1=O
InChIInChI=1S/C16H10Cl2N2O3/c17-9-5-3-7-11(13(9)18)20-16(23)12-14(21)8-4-1-2-6-10(8)19-15(12)22/h1-7H,(H,20,23)(H2,19,21,22)
InChIKeyXHJPBUJCVRLEOK-UHFFFAOYSA-N
MW349.17 g/mol
LogP3.79
Rot. Bonds2

About N-(2,3-dichlorophenyl)-4-hydroxy-2-oxo-1H-quinoline-3-carboxamide

N-(2,3-dichlorophenyl)-4-hydroxy-2-oxo-1H-quinoline-3-carboxamide (PubChem CID 54677085) has the molecular formula C16H10Cl2N2O3 and a molecular weight of 349.17 g/mol. Its IUPAC name is N-(2,3-dichlorophenyl)-4-hydroxy-2-oxo-1H-quinoline-3-carboxamide.

Molecular Properties

Compound NameN-(2,3-dichlorophenyl)-4-hydroxy-2-oxo-1H-quinoline-3-carboxamide
PubChem CID54677085
Molecular FormulaC16H10Cl2N2O3
Molecular Weight349.17 g/mol
Exact Mass348.01
IUPAC NameN-(2,3-dichlorophenyl)-4-hydroxy-2-oxo-1H-quinoline-3-carboxamide
SMILESO=C(Nc1cccc(Cl)c1Cl)c1c(O)c2ccccc2[nH]c1=O
InChIInChI=1S/C16H10Cl2N2O3/c17-9-5-3-7-11(13(9)18)20-16(23)12-14(21)8-4-1-2-6-10(8)19-15(12)22/h1-7H,(H,20,23)(H2,19,21,22)
InChIKeyXHJPBUJCVRLEOK-UHFFFAOYSA-N
XLogP3.79
TPSA82.19 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.17
LogP ≤ 53.79
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2,3-dichlorophenyl)-4-hydroxy-2-oxo-1H-quinoline-3-carboxamide?
The IUPAC name of N-(2,3-dichlorophenyl)-4-hydroxy-2-oxo-1H-quinoline-3-carboxamide (CID 54677085) is N-(2,3-dichlorophenyl)-4-hydroxy-2-oxo-1H-quinoline-3-carboxamide.
What is the SMILES notation for N-(2,3-dichlorophenyl)-4-hydroxy-2-oxo-1H-quinoline-3-carboxamide?
The canonical SMILES for N-(2,3-dichlorophenyl)-4-hydroxy-2-oxo-1H-quinoline-3-carboxamide is O=C(Nc1cccc(Cl)c1Cl)c1c(O)c2ccccc2[nH]c1=O.
What is the InChIKey of N-(2,3-dichlorophenyl)-4-hydroxy-2-oxo-1H-quinoline-3-carboxamide?
The InChIKey is XHJPBUJCVRLEOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10Cl2N2O3/c17-9-5-3-7-11(13(9)18)20-16(23)12-14(21)8-4-1-2-6-10(8)19-15(12)22/h1-7H,(H,20,23)(H2,19,21,22).
What are the key properties of N-(2,3-dichlorophenyl)-4-hydroxy-2-oxo-1H-quinoline-3-carboxamide?
N-(2,3-dichlorophenyl)-4-hydroxy-2-oxo-1H-quinoline-3-carboxamide has a molecular weight of 349.17 g/mol, XLogP of 3.79, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dichlorophenyl)-4-hydroxy-2-oxo-1H-quinoline-3-carboxamide is sourced from PubChem (CID 54677085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).