N-(3,4-difluorophenyl)-8-hydroxyquinoline-7-carboxamide;hydrochloride

C16H11ClF2N2O2 — CID 18372701

IUPACN-(3,4-difluorophenyl)-8-hydroxyquinoline-7-carboxamide;hydrochloride
SMILESCl.O=C(Nc1ccc(F)c(F)c1)c1ccc2cccnc2c1O
InChIInChI=1S/C16H10F2N2O2.ClH/c17-12-6-4-10(8-13(12)18)20-16(22)11-5-3-9-2-1-7-19-14(9)15(11)21;/h1-8,21H,(H,20,22);1H
InChIKeyQHQQEUSMQMLXKC-UHFFFAOYSA-N
MW336.73 g/mol
LogP3.89
Rot. Bonds2

About N-(3,4-difluorophenyl)-8-hydroxyquinoline-7-carboxamide;hydrochloride

N-(3,4-difluorophenyl)-8-hydroxyquinoline-7-carboxamide;hydrochloride (PubChem CID 18372701) has the molecular formula C16H11ClF2N2O2 and a molecular weight of 336.73 g/mol. Its IUPAC name is N-(3,4-difluorophenyl)-8-hydroxyquinoline-7-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(3,4-difluorophenyl)-8-hydroxyquinoline-7-carboxamide;hydrochloride
PubChem CID18372701
Molecular FormulaC16H11ClF2N2O2
Molecular Weight336.73 g/mol
Exact Mass336.05
IUPAC NameN-(3,4-difluorophenyl)-8-hydroxyquinoline-7-carboxamide;hydrochloride
SMILESCl.O=C(Nc1ccc(F)c(F)c1)c1ccc2cccnc2c1O
InChIInChI=1S/C16H10F2N2O2.ClH/c17-12-6-4-10(8-13(12)18)20-16(22)11-5-3-9-2-1-7-19-14(9)15(11)21;/h1-8,21H,(H,20,22);1H
InChIKeyQHQQEUSMQMLXKC-UHFFFAOYSA-N
XLogP3.89
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.73
LogP ≤ 53.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(9,10-dihydroanthracen-2-yl)-8-hydroxyquinoline-7-carboxamide
CID 20700238
N-(9H-fluoren-2-yl)-8-hydroxyquinoline-7-carboxamide;hydrochloride
CID 18372482
N-(5-fluoro-2-methylphenyl)-8-hydroxyquinoline-7-carboxamide
CID 18372561
N-(4-cyano-2-fluorophenyl)-8-hydroxyquinoline-7-carboxamide
CID 155523733
8-hydroxy-N-(4-morpholin-4-ylphenyl)quinoline-7-carboxamide
CID 53302491
8-hydroxy-N-[4-(4-nitrophenoxy)phenyl]quinoline-7-carboxamide;hydrochloride
CID 18372593
N-(3,4-difluorophenyl)-2-(methylamino)pyridine-3-carboxamide
CID 55138096
N-(3,4-difluorophenyl)-2-(ethylamino)pyridine-3-carboxamide
CID 62166522
N-(3,4-difluorophenyl)-2-(quinolin-8-ylamino)pyrimidine-5-carboxamide
CID 109270508
2-[(3,4-difluorophenyl)carbamoyl]pyridine-3-carboxylic acid
CID 19154756
N-(3,4-difluorophenyl)pyridine-2-carboxamide
CID 2571943
N-(2-bromophenyl)-8-hydroxyquinoline-7-carboxamide;methane
CID 161317877

Frequently Asked Questions

What is the IUPAC name of N-(3,4-difluorophenyl)-8-hydroxyquinoline-7-carboxamide;hydrochloride?
The IUPAC name of N-(3,4-difluorophenyl)-8-hydroxyquinoline-7-carboxamide;hydrochloride (CID 18372701) is N-(3,4-difluorophenyl)-8-hydroxyquinoline-7-carboxamide;hydrochloride.
What is the SMILES notation for N-(3,4-difluorophenyl)-8-hydroxyquinoline-7-carboxamide;hydrochloride?
The canonical SMILES for N-(3,4-difluorophenyl)-8-hydroxyquinoline-7-carboxamide;hydrochloride is Cl.O=C(Nc1ccc(F)c(F)c1)c1ccc2cccnc2c1O.
What is the InChIKey of N-(3,4-difluorophenyl)-8-hydroxyquinoline-7-carboxamide;hydrochloride?
The InChIKey is QHQQEUSMQMLXKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10F2N2O2.ClH/c17-12-6-4-10(8-13(12)18)20-16(22)11-5-3-9-2-1-7-19-14(9)15(11)21;/h1-8,21H,(H,20,22);1H.
What are the key properties of N-(3,4-difluorophenyl)-8-hydroxyquinoline-7-carboxamide;hydrochloride?
N-(3,4-difluorophenyl)-8-hydroxyquinoline-7-carboxamide;hydrochloride has a molecular weight of 336.73 g/mol, XLogP of 3.89, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-difluorophenyl)-8-hydroxyquinoline-7-carboxamide;hydrochloride is sourced from PubChem (CID 18372701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).