N-(2,4-difluorophenyl)-6-(3,4-dihydro-2H-quinolin-1-yl)pyridine-3-carboxamide

C21H17F2N3O — CID 109162499

IUPACN-(2,4-difluorophenyl)-6-(3,4-dihydro-2H-quinolin-1-yl)pyridine-3-carboxamide
SMILESO=C(Nc1ccc(F)cc1F)c1ccc(N2CCCc3ccccc32)nc1
InChIInChI=1S/C21H17F2N3O/c22-16-8-9-18(17(23)12-16)25-21(27)15-7-10-20(24-13-15)26-11-3-5-14-4-1-2-6-19(14)26/h1-2,4,6-10,12-13H,3,5,11H2,(H,25,27)
InChIKeyCCSUXKPTEGZBSE-UHFFFAOYSA-N
MW365.38 g/mol
LogP4.70
Rot. Bonds3

About N-(2,4-difluorophenyl)-6-(3,4-dihydro-2H-quinolin-1-yl)pyridine-3-carboxamide

N-(2,4-difluorophenyl)-6-(3,4-dihydro-2H-quinolin-1-yl)pyridine-3-carboxamide (PubChem CID 109162499) has the molecular formula C21H17F2N3O and a molecular weight of 365.38 g/mol. Its IUPAC name is N-(2,4-difluorophenyl)-6-(3,4-dihydro-2H-quinolin-1-yl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2,4-difluorophenyl)-6-(3,4-dihydro-2H-quinolin-1-yl)pyridine-3-carboxamide
PubChem CID109162499
Molecular FormulaC21H17F2N3O
Molecular Weight365.38 g/mol
Exact Mass365.13
IUPAC NameN-(2,4-difluorophenyl)-6-(3,4-dihydro-2H-quinolin-1-yl)pyridine-3-carboxamide
SMILESO=C(Nc1ccc(F)cc1F)c1ccc(N2CCCc3ccccc32)nc1
InChIInChI=1S/C21H17F2N3O/c22-16-8-9-18(17(23)12-16)25-21(27)15-7-10-20(24-13-15)26-11-3-5-14-4-1-2-6-19(14)26/h1-2,4,6-10,12-13H,3,5,11H2,(H,25,27)
InChIKeyCCSUXKPTEGZBSE-UHFFFAOYSA-N
XLogP4.70
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.38
LogP ≤ 54.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-(3,4-dihydro-2H-quinolin-1-yl)-N-(2-methoxyphenyl)pyridine-3-carboxamide
CID 84570395
N-(4-chlorophenyl)-6-(3,4-dihydro-2H-quinolin-1-yl)pyridine-3-carboxamide
CID 109162476
6-(3,4-dihydro-2H-quinolin-1-yl)-N-methylpyridine-3-carboxamide
CID 84570471
6-(3,4-dihydro-2H-quinolin-1-yl)-N-pyridin-2-ylpyridine-3-carboxamide
CID 84570413
N-(2,4-difluorophenyl)-6-(4-pyridin-2-ylpiperazin-1-yl)pyridine-3-carboxamide
CID 109160574
N-(2,4-difluorophenyl)-4-(3,4-dihydro-2H-quinolin-1-ylmethyl)benzamide
CID 38005181
N-[6-(3,4-dihydro-2H-quinolin-1-yl)-3-pyridinyl]-2-fluorobenzamide
CID 113016676
N-[6-(3,4-dihydro-2H-quinolin-1-yl)pyridazin-3-yl]-4-fluorobenzamide
CID 113046140
6-(3,4-dihydro-2H-quinolin-1-yl)-N-(4-ethoxyphenyl)pyridine-3-carboxamide
CID 109162480
N-(2,4-difluorophenyl)-6-pyrazol-1-ylpyridine-3-carboxamide
CID 3567091
5-(3,4-dihydro-2H-quinolin-1-yl)-N-(3-fluorophenyl)pyrazine-2-carboxamide
CID 109290679
6-(2,3-dihydroindol-1-yl)-N-(2,4,6-trimethylphenyl)pyridine-3-carboxamide
CID 84570241

Frequently Asked Questions

What is the IUPAC name of N-(2,4-difluorophenyl)-6-(3,4-dihydro-2H-quinolin-1-yl)pyridine-3-carboxamide?
The IUPAC name of N-(2,4-difluorophenyl)-6-(3,4-dihydro-2H-quinolin-1-yl)pyridine-3-carboxamide (CID 109162499) is N-(2,4-difluorophenyl)-6-(3,4-dihydro-2H-quinolin-1-yl)pyridine-3-carboxamide.
What is the SMILES notation for N-(2,4-difluorophenyl)-6-(3,4-dihydro-2H-quinolin-1-yl)pyridine-3-carboxamide?
The canonical SMILES for N-(2,4-difluorophenyl)-6-(3,4-dihydro-2H-quinolin-1-yl)pyridine-3-carboxamide is O=C(Nc1ccc(F)cc1F)c1ccc(N2CCCc3ccccc32)nc1.
What is the InChIKey of N-(2,4-difluorophenyl)-6-(3,4-dihydro-2H-quinolin-1-yl)pyridine-3-carboxamide?
The InChIKey is CCSUXKPTEGZBSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17F2N3O/c22-16-8-9-18(17(23)12-16)25-21(27)15-7-10-20(24-13-15)26-11-3-5-14-4-1-2-6-19(14)26/h1-2,4,6-10,12-13H,3,5,11H2,(H,25,27).
What are the key properties of N-(2,4-difluorophenyl)-6-(3,4-dihydro-2H-quinolin-1-yl)pyridine-3-carboxamide?
N-(2,4-difluorophenyl)-6-(3,4-dihydro-2H-quinolin-1-yl)pyridine-3-carboxamide has a molecular weight of 365.38 g/mol, XLogP of 4.70, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-difluorophenyl)-6-(3,4-dihydro-2H-quinolin-1-yl)pyridine-3-carboxamide is sourced from PubChem (CID 109162499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).