2-amino-3-fluoro-N-quinolin-8-ylpyridine-4-carboxamide

C15H11FN4O — CID 105384038

IUPAC2-amino-3-fluoro-N-quinolin-8-ylpyridine-4-carboxamide
SMILESNc1nccc(C(=O)Nc2cccc3cccnc23)c1F
InChIInChI=1S/C15H11FN4O/c16-12-10(6-8-19-14(12)17)15(21)20-11-5-1-3-9-4-2-7-18-13(9)11/h1-8H,(H2,17,19)(H,20,21)
InChIKeyMCHZNQBYNAORDZ-UHFFFAOYSA-N
MW282.28 g/mol
LogP2.60
Rot. Bonds2

About 2-amino-3-fluoro-N-quinolin-8-ylpyridine-4-carboxamide

2-amino-3-fluoro-N-quinolin-8-ylpyridine-4-carboxamide (PubChem CID 105384038) has the molecular formula C15H11FN4O and a molecular weight of 282.28 g/mol. Its IUPAC name is 2-amino-3-fluoro-N-quinolin-8-ylpyridine-4-carboxamide.

Molecular Properties

Compound Name2-amino-3-fluoro-N-quinolin-8-ylpyridine-4-carboxamide
PubChem CID105384038
Molecular FormulaC15H11FN4O
Molecular Weight282.28 g/mol
Exact Mass282.09
IUPAC Name2-amino-3-fluoro-N-quinolin-8-ylpyridine-4-carboxamide
SMILESNc1nccc(C(=O)Nc2cccc3cccnc23)c1F
InChIInChI=1S/C15H11FN4O/c16-12-10(6-8-19-14(12)17)15(21)20-11-5-1-3-9-4-2-7-18-13(9)11/h1-8H,(H2,17,19)(H,20,21)
InChIKeyMCHZNQBYNAORDZ-UHFFFAOYSA-N
XLogP2.60
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.28
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-3-fluoro-N-isoquinolin-5-ylpyridine-4-carboxamide
CID 105385052
3-fluoro-2-hydroxy-N-quinolin-8-ylbenzamide
CID 46846762
5-chloro-2-fluoro-N-quinolin-8-ylbenzamide
CID 17416993
2-amino-3-bromo-N-quinolin-8-ylbenzamide
CID 110451344
2-amino-N-(2,6-difluorophenyl)-3-fluoropyridine-4-carboxamide
CID 105384666
4-fluoro-2-hydroxy-N-quinolin-8-ylbenzamide
CID 46846864
2-amino-3-fluoro-N-pyridin-2-ylpyridine-4-carboxamide
CID 105384358
2-chloro-N-quinolin-8-ylfuran-3-carboxamide
CID 106685180
5-bromo-2-fluoro-N-quinolin-8-ylbenzamide
CID 24710942
2-amino-3-fluoro-N-[2-(2-methoxyethyl)phenyl]pyridine-4-carboxamide
CID 102907943
2-(aminomethyl)-N-quinolin-8-ylbenzamide
CID 82546402
2-amino-N-(2-ethoxyphenyl)-3-fluoropyridine-4-carboxamide
CID 105384040

Frequently Asked Questions

What is the IUPAC name of 2-amino-3-fluoro-N-quinolin-8-ylpyridine-4-carboxamide?
The IUPAC name of 2-amino-3-fluoro-N-quinolin-8-ylpyridine-4-carboxamide (CID 105384038) is 2-amino-3-fluoro-N-quinolin-8-ylpyridine-4-carboxamide.
What is the SMILES notation for 2-amino-3-fluoro-N-quinolin-8-ylpyridine-4-carboxamide?
The canonical SMILES for 2-amino-3-fluoro-N-quinolin-8-ylpyridine-4-carboxamide is Nc1nccc(C(=O)Nc2cccc3cccnc23)c1F.
What is the InChIKey of 2-amino-3-fluoro-N-quinolin-8-ylpyridine-4-carboxamide?
The InChIKey is MCHZNQBYNAORDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11FN4O/c16-12-10(6-8-19-14(12)17)15(21)20-11-5-1-3-9-4-2-7-18-13(9)11/h1-8H,(H2,17,19)(H,20,21).
What are the key properties of 2-amino-3-fluoro-N-quinolin-8-ylpyridine-4-carboxamide?
2-amino-3-fluoro-N-quinolin-8-ylpyridine-4-carboxamide has a molecular weight of 282.28 g/mol, XLogP of 2.60, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-fluoro-N-quinolin-8-ylpyridine-4-carboxamide is sourced from PubChem (CID 105384038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).