N-(4-chlorophenyl)-8-hydroxyquinoline-7-carboxamide

C16H11ClN2O2 — CID 18372520

IUPACN-(4-chlorophenyl)-8-hydroxyquinoline-7-carboxamide
SMILESO=C(Nc1ccc(Cl)cc1)c1ccc2cccnc2c1O
InChIInChI=1S/C16H11ClN2O2/c17-11-4-6-12(7-5-11)19-16(21)13-8-3-10-2-1-9-18-14(10)15(13)20/h1-9,20H,(H,19,21)
InChIKeyPFUIZFIWMJOCQS-UHFFFAOYSA-N
MW298.73 g/mol
LogP3.85
Rot. Bonds2

About N-(4-chlorophenyl)-8-hydroxyquinoline-7-carboxamide

N-(4-chlorophenyl)-8-hydroxyquinoline-7-carboxamide (PubChem CID 18372520) has the molecular formula C16H11ClN2O2 and a molecular weight of 298.73 g/mol. Its IUPAC name is N-(4-chlorophenyl)-8-hydroxyquinoline-7-carboxamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)-8-hydroxyquinoline-7-carboxamide
PubChem CID18372520
Molecular FormulaC16H11ClN2O2
Molecular Weight298.73 g/mol
Exact Mass298.05
IUPAC NameN-(4-chlorophenyl)-8-hydroxyquinoline-7-carboxamide
SMILESO=C(Nc1ccc(Cl)cc1)c1ccc2cccnc2c1O
InChIInChI=1S/C16H11ClN2O2/c17-11-4-6-12(7-5-11)19-16(21)13-8-3-10-2-1-9-18-14(10)15(13)20/h1-9,20H,(H,19,21)
InChIKeyPFUIZFIWMJOCQS-UHFFFAOYSA-N
XLogP3.85
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.73
LogP ≤ 53.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-8-hydroxyquinoline-7-carboxamide?
The IUPAC name of N-(4-chlorophenyl)-8-hydroxyquinoline-7-carboxamide (CID 18372520) is N-(4-chlorophenyl)-8-hydroxyquinoline-7-carboxamide.
What is the SMILES notation for N-(4-chlorophenyl)-8-hydroxyquinoline-7-carboxamide?
The canonical SMILES for N-(4-chlorophenyl)-8-hydroxyquinoline-7-carboxamide is O=C(Nc1ccc(Cl)cc1)c1ccc2cccnc2c1O.
What is the InChIKey of N-(4-chlorophenyl)-8-hydroxyquinoline-7-carboxamide?
The InChIKey is PFUIZFIWMJOCQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11ClN2O2/c17-11-4-6-12(7-5-11)19-16(21)13-8-3-10-2-1-9-18-14(10)15(13)20/h1-9,20H,(H,19,21).
What are the key properties of N-(4-chlorophenyl)-8-hydroxyquinoline-7-carboxamide?
N-(4-chlorophenyl)-8-hydroxyquinoline-7-carboxamide has a molecular weight of 298.73 g/mol, XLogP of 3.85, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-8-hydroxyquinoline-7-carboxamide is sourced from PubChem (CID 18372520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).