N-(2,6-difluorophenyl)-6-(3,4-dihydro-2H-quinoline-1-carbonyl)pyridine-2-carboxamide

C22H17F2N3O2 — CID 109100371

IUPACN-(2,6-difluorophenyl)-6-(3,4-dihydro-2H-quinoline-1-carbonyl)pyridine-2-carboxamide
SMILESO=C(Nc1c(F)cccc1F)c1cccc(C(=O)N2CCCc3ccccc32)n1
InChIInChI=1S/C22H17F2N3O2/c23-15-8-3-9-16(24)20(15)26-21(28)17-10-4-11-18(25-17)22(29)27-13-5-7-14-6-1-2-12-19(14)27/h1-4,6,8-12H,5,7,13H2,(H,26,28)
InChIKeyDZQGCYUTZVAKPO-UHFFFAOYSA-N
MW393.39 g/mol
LogP4.21
Rot. Bonds3

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

N-(2,6-difluorophenyl)-6-(3,4-dihydro-2H-quinoline-1-carbonyl)pyridine-2-carboxamide (PubChem CID 109100371) has the molecular formula C22H17F2N3O2 and a molecular weight of 393.39 g/mol. Its IUPAC name is N-(2,6-difluorophenyl)-6-(3,4-dihydro-2H-quinoline-1-carbonyl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(2,6-difluorophenyl)-6-(3,4-dihydro-2H-quinoline-1-carbonyl)pyridine-2-carboxamide
PubChem CID109100371
Molecular FormulaC22H17F2N3O2
Molecular Weight393.39 g/mol
Exact Mass393.13
IUPAC NameN-(2,6-difluorophenyl)-6-(3,4-dihydro-2H-quinoline-1-carbonyl)pyridine-2-carboxamide
SMILESO=C(Nc1c(F)cccc1F)c1cccc(C(=O)N2CCCc3ccccc32)n1
InChIInChI=1S/C22H17F2N3O2/c23-15-8-3-9-16(24)20(15)26-21(28)17-10-4-11-18(25-17)22(29)27-13-5-7-14-6-1-2-12-19(14)27/h1-4,6,8-12H,5,7,13H2,(H,26,28)
InChIKeyDZQGCYUTZVAKPO-UHFFFAOYSA-N
XLogP4.21
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.39
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,6-difluorophenyl)-6-(2,3-dihydroindole-1-carbonyl)pyridine-2-carboxamide
CID 109100342
6-(3,4-dihydro-2H-quinoline-1-carbonyl)-N-(4-methylphenyl)pyridine-2-carboxamide
CID 109100170
6-(3,4-dihydro-2H-quinoline-1-carbonyl)pyridine-2-carboxylic acid
CID 43558372
N-tert-butyl-6-(3,4-dihydro-2H-quinoline-1-carbonyl)pyridine-2-carboxamide
CID 109099143
6-(2,3-dihydroindole-1-carbonyl)-N-(4-methylphenyl)pyridine-2-carboxamide
CID 109100169
[4-(2,6-difluoroanilino)-2-pyridinyl]-(3,4-dihydro-2H-quinolin-1-yl)methanone
CID 109219687
[2-(2,6-difluoroanilino)-6-methylpyrimidin-4-yl]-(3,4-dihydro-2H-quinolin-1-yl)methanone
CID 109335606
N-(4-cyanophenyl)-6-(2,3-dihydroindole-1-carbonyl)pyridine-2-carboxamide
CID 109100339
[6-(azepan-1-yl)-2-pyridinyl]-(3,4-dihydro-2H-quinolin-1-yl)methanone
CID 84573748
3,4-dihydro-2H-quinolin-1-yl-(6-piperidin-1-yl-2-pyridinyl)methanone
CID 84573646
3,4-dihydro-2H-quinolin-1-yl-(6-morpholin-4-yl-2-pyridinyl)methanone
CID 84573879
[6-(cyclopropylamino)-2-pyridinyl]-(3,4-dihydro-2H-quinolin-1-yl)methanone
CID 84570920

Frequently Asked Questions

What is the IUPAC name of N-(2,6-difluorophenyl)-6-(3,4-dihydro-2H-quinoline-1-carbonyl)pyridine-2-carboxamide?
The IUPAC name of N-(2,6-difluorophenyl)-6-(3,4-dihydro-2H-quinoline-1-carbonyl)pyridine-2-carboxamide (CID 109100371) is N-(2,6-difluorophenyl)-6-(3,4-dihydro-2H-quinoline-1-carbonyl)pyridine-2-carboxamide.
What is the SMILES notation for N-(2,6-difluorophenyl)-6-(3,4-dihydro-2H-quinoline-1-carbonyl)pyridine-2-carboxamide?
The canonical SMILES for N-(2,6-difluorophenyl)-6-(3,4-dihydro-2H-quinoline-1-carbonyl)pyridine-2-carboxamide is O=C(Nc1c(F)cccc1F)c1cccc(C(=O)N2CCCc3ccccc32)n1.
What is the InChIKey of N-(2,6-difluorophenyl)-6-(3,4-dihydro-2H-quinoline-1-carbonyl)pyridine-2-carboxamide?
The InChIKey is DZQGCYUTZVAKPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17F2N3O2/c23-15-8-3-9-16(24)20(15)26-21(28)17-10-4-11-18(25-17)22(29)27-13-5-7-14-6-1-2-12-19(14)27/h1-4,6,8-12H,5,7,13H2,(H,26,28).
What are the key properties of N-(2,6-difluorophenyl)-6-(3,4-dihydro-2H-quinoline-1-carbonyl)pyridine-2-carboxamide?
N-(2,6-difluorophenyl)-6-(3,4-dihydro-2H-quinoline-1-carbonyl)pyridine-2-carboxamide has a molecular weight of 393.39 g/mol, XLogP of 4.21, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-difluorophenyl)-6-(3,4-dihydro-2H-quinoline-1-carbonyl)pyridine-2-carboxamide is sourced from PubChem (CID 109100371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).