8-hydroxy-N-[2-methoxy-5-(trifluoromethyl)phenyl]quinoline-7-carboxamide

C18H13F3N2O3 — CID 18372533

IUPAC8-hydroxy-N-[2-methoxy-5-(trifluoromethyl)phenyl]quinoline-7-carboxamide
SMILESCOc1ccc(C(F)(F)F)cc1NC(=O)c1ccc2cccnc2c1O
InChIInChI=1S/C18H13F3N2O3/c1-26-14-7-5-11(18(19,20)21)9-13(14)23-17(25)12-6-4-10-3-2-8-22-15(10)16(12)24/h2-9,24H,1H3,(H,23,25)
InChIKeyFKRLHKWPGMFQCU-UHFFFAOYSA-N
MW362.31 g/mol
LogP4.22
Rot. Bonds3

About 8-hydroxy-N-[2-methoxy-5-(trifluoromethyl)phenyl]quinoline-7-carboxamide

8-hydroxy-N-[2-methoxy-5-(trifluoromethyl)phenyl]quinoline-7-carboxamide (PubChem CID 18372533) has the molecular formula C18H13F3N2O3 and a molecular weight of 362.31 g/mol. Its IUPAC name is 8-hydroxy-N-[2-methoxy-5-(trifluoromethyl)phenyl]quinoline-7-carboxamide.

Molecular Properties

Compound Name8-hydroxy-N-[2-methoxy-5-(trifluoromethyl)phenyl]quinoline-7-carboxamide
PubChem CID18372533
Molecular FormulaC18H13F3N2O3
Molecular Weight362.31 g/mol
Exact Mass362.09
IUPAC Name8-hydroxy-N-[2-methoxy-5-(trifluoromethyl)phenyl]quinoline-7-carboxamide
SMILESCOc1ccc(C(F)(F)F)cc1NC(=O)c1ccc2cccnc2c1O
InChIInChI=1S/C18H13F3N2O3/c1-26-14-7-5-11(18(19,20)21)9-13(14)23-17(25)12-6-4-10-3-2-8-22-15(10)16(12)24/h2-9,24H,1H3,(H,23,25)
InChIKeyFKRLHKWPGMFQCU-UHFFFAOYSA-N
XLogP4.22
TPSA71.45 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.31
LogP ≤ 54.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-hydroxy-N-[2-methoxy-5-(trifluoromethyl)phenyl]naphthalene-2-carboxamide
CID 20604816
N-(5-fluoro-2-methylphenyl)-8-hydroxyquinoline-7-carboxamide
CID 18372561
N-(5-acetamido-2-methoxyphenyl)quinoline-8-carboxamide
CID 17443177
2-[2-methoxy-5-(trifluoromethyl)anilino]pyridine-3-carboxylic acid
CID 178064922
8-hydroxy-N-[(4-hydroxy-3-methoxyphenyl)methyl]quinoline-7-carboxamide
CID 18372541
2-anilino-N-quinolin-8-yl-5-(trifluoromethyl)benzamide
CID 134849172
N-[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]isoquinoline-1-carboxamide
CID 60604524
N-(2-bromophenyl)-8-hydroxyquinoline-7-carboxamide;methane
CID 161317877
2-butyl-N-quinolin-8-yl-5-(trifluoromethyl)benzamide
CID 71657963
1-[2-methoxy-5-(trifluoromethyl)phenyl]-3-[2-(trifluoromethyl)phenyl]urea
CID 86609606
N-isoquinolin-4-yl-2-methoxy-5-(trifluoromethyl)benzamide
CID 166085769
N-[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]quinoline-2-carboxamide
CID 26177558

Frequently Asked Questions

What is the IUPAC name of 8-hydroxy-N-[2-methoxy-5-(trifluoromethyl)phenyl]quinoline-7-carboxamide?
The IUPAC name of 8-hydroxy-N-[2-methoxy-5-(trifluoromethyl)phenyl]quinoline-7-carboxamide (CID 18372533) is 8-hydroxy-N-[2-methoxy-5-(trifluoromethyl)phenyl]quinoline-7-carboxamide.
What is the SMILES notation for 8-hydroxy-N-[2-methoxy-5-(trifluoromethyl)phenyl]quinoline-7-carboxamide?
The canonical SMILES for 8-hydroxy-N-[2-methoxy-5-(trifluoromethyl)phenyl]quinoline-7-carboxamide is COc1ccc(C(F)(F)F)cc1NC(=O)c1ccc2cccnc2c1O.
What is the InChIKey of 8-hydroxy-N-[2-methoxy-5-(trifluoromethyl)phenyl]quinoline-7-carboxamide?
The InChIKey is FKRLHKWPGMFQCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13F3N2O3/c1-26-14-7-5-11(18(19,20)21)9-13(14)23-17(25)12-6-4-10-3-2-8-22-15(10)16(12)24/h2-9,24H,1H3,(H,23,25).
What are the key properties of 8-hydroxy-N-[2-methoxy-5-(trifluoromethyl)phenyl]quinoline-7-carboxamide?
8-hydroxy-N-[2-methoxy-5-(trifluoromethyl)phenyl]quinoline-7-carboxamide has a molecular weight of 362.31 g/mol, XLogP of 4.22, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-hydroxy-N-[2-methoxy-5-(trifluoromethyl)phenyl]quinoline-7-carboxamide is sourced from PubChem (CID 18372533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).