5-[2-(2-fluorophenyl)ethylamino]-N-quinolin-8-ylpyridine-2-carboxamide

C23H19FN4O — CID 109192303

IUPAC5-[2-(2-fluorophenyl)ethylamino]-N-quinolin-8-ylpyridine-2-carboxamide
SMILESO=C(Nc1cccc2cccnc12)c1ccc(NCCc2ccccc2F)cn1
InChIInChI=1S/C23H19FN4O/c24-19-8-2-1-5-16(19)12-14-25-18-10-11-21(27-15-18)23(29)28-20-9-3-6-17-7-4-13-26-22(17)20/h1-11,13,15,25H,12,14H2,(H,28,29)
InChIKeyLBNILLLYCOKVCH-UHFFFAOYSA-N
MW386.43 g/mol
LogP4.68
Rot. Bonds6

About 5-[2-(2-fluorophenyl)ethylamino]-N-quinolin-8-ylpyridine-2-carboxamide

5-[2-(2-fluorophenyl)ethylamino]-N-quinolin-8-ylpyridine-2-carboxamide (PubChem CID 109192303) has the molecular formula C23H19FN4O and a molecular weight of 386.43 g/mol. Its IUPAC name is 5-[2-(2-fluorophenyl)ethylamino]-N-quinolin-8-ylpyridine-2-carboxamide.

Molecular Properties

Compound Name5-[2-(2-fluorophenyl)ethylamino]-N-quinolin-8-ylpyridine-2-carboxamide
PubChem CID109192303
Molecular FormulaC23H19FN4O
Molecular Weight386.43 g/mol
Exact Mass386.15
IUPAC Name5-[2-(2-fluorophenyl)ethylamino]-N-quinolin-8-ylpyridine-2-carboxamide
SMILESO=C(Nc1cccc2cccnc12)c1ccc(NCCc2ccccc2F)cn1
InChIInChI=1S/C23H19FN4O/c24-19-8-2-1-5-16(19)12-14-25-18-10-11-21(27-15-18)23(29)28-20-9-3-6-17-7-4-13-26-22(17)20/h1-11,13,15,25H,12,14H2,(H,28,29)
InChIKeyLBNILLLYCOKVCH-UHFFFAOYSA-N
XLogP4.68
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.43
LogP ≤ 54.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-[(2-chlorophenyl)methylamino]-N-quinolin-8-ylpyridine-2-carboxamide
CID 109189981
5-(butylamino)-N-quinolin-8-ylpyridine-2-carboxamide
CID 109180980
5-(pyridin-2-ylmethylamino)-N-quinolin-8-ylpyridine-2-carboxamide
CID 109191143
3-[2-(2-fluorophenyl)ethylamino]-N-quinolin-8-ylpropanamide
CID 109024907
5-(methylamino)-N-quinolin-8-ylpyridine-2-carboxamide
CID 104639694
N-(2,6-difluorophenyl)-5-(quinolin-8-ylamino)pyridine-2-carboxamide
CID 109200781
5-(2-methylpropylamino)-N-quinolin-8-ylpyridine-2-carboxamide
CID 109181365
5-[(2-fluorophenyl)methylamino]-N-quinolin-8-ylpyridine-3-carboxamide
CID 109233513
N-[2-(2-fluorophenyl)ethyl]-5-(2-phenylethylamino)pyridine-2-carboxamide
CID 109191848
4-(2-phenylethylamino)-N-quinolin-8-ylpyridine-2-carboxamide
CID 109213726
5-(cyclopropylamino)-N-quinolin-8-ylpyridine-2-carboxamide
CID 109180200
5-(2-methoxyanilino)-N-quinolin-8-ylpyridine-2-carboxamide
CID 109199751

Frequently Asked Questions

What is the IUPAC name of 5-[2-(2-fluorophenyl)ethylamino]-N-quinolin-8-ylpyridine-2-carboxamide?
The IUPAC name of 5-[2-(2-fluorophenyl)ethylamino]-N-quinolin-8-ylpyridine-2-carboxamide (CID 109192303) is 5-[2-(2-fluorophenyl)ethylamino]-N-quinolin-8-ylpyridine-2-carboxamide.
What is the SMILES notation for 5-[2-(2-fluorophenyl)ethylamino]-N-quinolin-8-ylpyridine-2-carboxamide?
The canonical SMILES for 5-[2-(2-fluorophenyl)ethylamino]-N-quinolin-8-ylpyridine-2-carboxamide is O=C(Nc1cccc2cccnc12)c1ccc(NCCc2ccccc2F)cn1.
What is the InChIKey of 5-[2-(2-fluorophenyl)ethylamino]-N-quinolin-8-ylpyridine-2-carboxamide?
The InChIKey is LBNILLLYCOKVCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H19FN4O/c24-19-8-2-1-5-16(19)12-14-25-18-10-11-21(27-15-18)23(29)28-20-9-3-6-17-7-4-13-26-22(17)20/h1-11,13,15,25H,12,14H2,(H,28,29).
What are the key properties of 5-[2-(2-fluorophenyl)ethylamino]-N-quinolin-8-ylpyridine-2-carboxamide?
5-[2-(2-fluorophenyl)ethylamino]-N-quinolin-8-ylpyridine-2-carboxamide has a molecular weight of 386.43 g/mol, XLogP of 4.68, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(2-fluorophenyl)ethylamino]-N-quinolin-8-ylpyridine-2-carboxamide is sourced from PubChem (CID 109192303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).