N-(3-cyano-4-fluorophenyl)-3-methylpyridine-2-carboxamide

C14H10FN3O — CID 62340831

IUPACN-(3-cyano-4-fluorophenyl)-3-methylpyridine-2-carboxamide
SMILESCc1cccnc1C(=O)Nc1ccc(F)c(C#N)c1
InChIInChI=1S/C14H10FN3O/c1-9-3-2-6-17-13(9)14(19)18-11-4-5-12(15)10(7-11)8-16/h2-7H,1H3,(H,18,19)
InChIKeyHQQBRFRLOLRHSR-UHFFFAOYSA-N
MW255.25 g/mol
LogP2.65
Rot. Bonds2

About N-(3-cyano-4-fluorophenyl)-3-methylpyridine-2-carboxamide

N-(3-cyano-4-fluorophenyl)-3-methylpyridine-2-carboxamide (PubChem CID 62340831) has the molecular formula C14H10FN3O and a molecular weight of 255.25 g/mol. Its IUPAC name is N-(3-cyano-4-fluorophenyl)-3-methylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-(3-cyano-4-fluorophenyl)-3-methylpyridine-2-carboxamide
PubChem CID62340831
Molecular FormulaC14H10FN3O
Molecular Weight255.25 g/mol
Exact Mass255.08
IUPAC NameN-(3-cyano-4-fluorophenyl)-3-methylpyridine-2-carboxamide
SMILESCc1cccnc1C(=O)Nc1ccc(F)c(C#N)c1
InChIInChI=1S/C14H10FN3O/c1-9-3-2-6-17-13(9)14(19)18-11-4-5-12(15)10(7-11)8-16/h2-7H,1H3,(H,18,19)
InChIKeyHQQBRFRLOLRHSR-UHFFFAOYSA-N
XLogP2.65
TPSA65.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.25
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-cyano-4-fluorophenyl)-2,4,6-trimethylbenzamide
CID 62315615
N-(4-bromo-3-methylphenyl)-3-methylpyridine-2-carboxamide
CID 62338956
N-(3-cyano-4-fluorophenyl)-3-methylfuran-2-carboxamide
CID 62315619
N-(3-cyano-4-fluorophenyl)-4-fluoro-2-methylbenzamide
CID 115745574
3-bromo-N-(3,4-dicyanophenyl)pyridine-2-carboxamide
CID 107791028
2-bromo-N-(3-cyano-4-fluorophenyl)pyridine-4-carboxamide
CID 113255679
N-(3-cyano-4-fluorophenyl)-2-(2-methylphenyl)acetamide
CID 62315790
N-(4-fluoro-3-methylphenyl)-3-(3-hydroxyprop-1-ynyl)pyridine-2-carboxamide
CID 107522279
N-(3-cyano-4-fluorophenyl)-6-fluoropyridine-3-carboxamide
CID 63978798
N-(4-iodophenyl)-3-methylpyridine-2-carboxamide
CID 62339482
5-amino-N-(3-cyano-4-fluorophenyl)-2-methylbenzamide
CID 62318012
N-(3-cyano-4-fluorophenyl)-6-fluoropyridine-2-carboxamide
CID 113323580

Frequently Asked Questions

What is the IUPAC name of N-(3-cyano-4-fluorophenyl)-3-methylpyridine-2-carboxamide?
The IUPAC name of N-(3-cyano-4-fluorophenyl)-3-methylpyridine-2-carboxamide (CID 62340831) is N-(3-cyano-4-fluorophenyl)-3-methylpyridine-2-carboxamide.
What is the SMILES notation for N-(3-cyano-4-fluorophenyl)-3-methylpyridine-2-carboxamide?
The canonical SMILES for N-(3-cyano-4-fluorophenyl)-3-methylpyridine-2-carboxamide is Cc1cccnc1C(=O)Nc1ccc(F)c(C#N)c1.
What is the InChIKey of N-(3-cyano-4-fluorophenyl)-3-methylpyridine-2-carboxamide?
The InChIKey is HQQBRFRLOLRHSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10FN3O/c1-9-3-2-6-17-13(9)14(19)18-11-4-5-12(15)10(7-11)8-16/h2-7H,1H3,(H,18,19).
What are the key properties of N-(3-cyano-4-fluorophenyl)-3-methylpyridine-2-carboxamide?
N-(3-cyano-4-fluorophenyl)-3-methylpyridine-2-carboxamide has a molecular weight of 255.25 g/mol, XLogP of 2.65, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyano-4-fluorophenyl)-3-methylpyridine-2-carboxamide is sourced from PubChem (CID 62340831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).