8-hydroxy-N,N-diphenylquinoline-7-carboxamide;hydrochloride

C22H17ClN2O2 — CID 70164229

IUPAC8-hydroxy-N,N-diphenylquinoline-7-carboxamide;hydrochloride
SMILESCl.O=C(c1ccc2cccnc2c1O)N(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H16N2O2.ClH/c25-21-19(14-13-16-8-7-15-23-20(16)21)22(26)24(17-9-3-1-4-10-17)18-11-5-2-6-12-18;/h1-15,25H;1H
InChIKeyZZPQCPTWUVEBOY-UHFFFAOYSA-N
MW376.84 g/mol
LogP5.34
Rot. Bonds3

About 8-hydroxy-N,N-diphenylquinoline-7-carboxamide;hydrochloride

8-hydroxy-N,N-diphenylquinoline-7-carboxamide;hydrochloride (PubChem CID 70164229) has the molecular formula C22H17ClN2O2 and a molecular weight of 376.84 g/mol. Its IUPAC name is 8-hydroxy-N,N-diphenylquinoline-7-carboxamide;hydrochloride.

Molecular Properties

Compound Name8-hydroxy-N,N-diphenylquinoline-7-carboxamide;hydrochloride
PubChem CID70164229
Molecular FormulaC22H17ClN2O2
Molecular Weight376.84 g/mol
Exact Mass376.10
IUPAC Name8-hydroxy-N,N-diphenylquinoline-7-carboxamide;hydrochloride
SMILESCl.O=C(c1ccc2cccnc2c1O)N(c1ccccc1)c1ccccc1
InChIInChI=1S/C22H16N2O2.ClH/c25-21-19(14-13-16-8-7-15-23-20(16)21)22(26)24(17-9-3-1-4-10-17)18-11-5-2-6-12-18;/h1-15,25H;1H
InChIKeyZZPQCPTWUVEBOY-UHFFFAOYSA-N
XLogP5.34
TPSA53.43 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms27
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500376.84
LogP ≤ 55.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 8-hydroxy-N,N-diphenylquinoline-7-carboxamide;hydrochloride?
The IUPAC name of 8-hydroxy-N,N-diphenylquinoline-7-carboxamide;hydrochloride (CID 70164229) is 8-hydroxy-N,N-diphenylquinoline-7-carboxamide;hydrochloride.
What is the SMILES notation for 8-hydroxy-N,N-diphenylquinoline-7-carboxamide;hydrochloride?
The canonical SMILES for 8-hydroxy-N,N-diphenylquinoline-7-carboxamide;hydrochloride is Cl.O=C(c1ccc2cccnc2c1O)N(c1ccccc1)c1ccccc1.
What is the InChIKey of 8-hydroxy-N,N-diphenylquinoline-7-carboxamide;hydrochloride?
The InChIKey is ZZPQCPTWUVEBOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H16N2O2.ClH/c25-21-19(14-13-16-8-7-15-23-20(16)21)22(26)24(17-9-3-1-4-10-17)18-11-5-2-6-12-18;/h1-15,25H;1H.
What are the key properties of 8-hydroxy-N,N-diphenylquinoline-7-carboxamide;hydrochloride?
8-hydroxy-N,N-diphenylquinoline-7-carboxamide;hydrochloride has a molecular weight of 376.84 g/mol, XLogP of 5.34, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-hydroxy-N,N-diphenylquinoline-7-carboxamide;hydrochloride is sourced from PubChem (CID 70164229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).