N-(2-cyano-3-fluorophenyl)-6-(methylamino)pyridine-2-carboxamide

C14H11FN4O — CID 62240838

IUPACN-(2-cyano-3-fluorophenyl)-6-(methylamino)pyridine-2-carboxamide
SMILESCNc1cccc(C(=O)Nc2cccc(F)c2C#N)n1
InChIInChI=1S/C14H11FN4O/c1-17-13-7-3-6-12(18-13)14(20)19-11-5-2-4-10(15)9(11)8-16/h2-7H,1H3,(H,17,18)(H,19,20)
InChIKeyVGIAQXSLKSLLOT-UHFFFAOYSA-N
MW270.27 g/mol
LogP2.39
Rot. Bonds3

About N-(2-cyano-3-fluorophenyl)-6-(methylamino)pyridine-2-carboxamide

N-(2-cyano-3-fluorophenyl)-6-(methylamino)pyridine-2-carboxamide (PubChem CID 62240838) has the molecular formula C14H11FN4O and a molecular weight of 270.27 g/mol. Its IUPAC name is N-(2-cyano-3-fluorophenyl)-6-(methylamino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(2-cyano-3-fluorophenyl)-6-(methylamino)pyridine-2-carboxamide
PubChem CID62240838
Molecular FormulaC14H11FN4O
Molecular Weight270.27 g/mol
Exact Mass270.09
IUPAC NameN-(2-cyano-3-fluorophenyl)-6-(methylamino)pyridine-2-carboxamide
SMILESCNc1cccc(C(=O)Nc2cccc(F)c2C#N)n1
InChIInChI=1S/C14H11FN4O/c1-17-13-7-3-6-12(18-13)14(20)19-11-5-2-4-10(15)9(11)8-16/h2-7H,1H3,(H,17,18)(H,19,20)
InChIKeyVGIAQXSLKSLLOT-UHFFFAOYSA-N
XLogP2.39
TPSA77.81 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.27
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-chloro-N-(2-cyano-3-fluorophenyl)pyridine-2-carboxamide
CID 62232716
2-fluoro-6-[[6-(methylamino)-2-pyridinyl]amino]benzonitrile
CID 80792103
5-cyano-N-(2-cyano-3-fluorophenyl)pyridine-2-carboxamide
CID 63724379
N-(2-chlorophenyl)-6-(methylamino)pyridine-2-carboxamide
CID 62241147
N-(2-cyano-3-fluorophenyl)-6-hydrazinylpyridazine-3-carboxamide
CID 62235962
N-(2-cyano-3-fluorophenyl)quinoxaline-2-carboxamide
CID 95763379
N-(2-cyano-3-fluorophenyl)-6-(ethylamino)pyridazine-3-carboxamide
CID 62169600
6-amino-N-(2-cyano-3-fluorophenyl)pyridazine-3-carboxamide
CID 62155166
N-(5-bromo-2-cyanophenyl)-6-(methylamino)pyridine-2-carboxamide
CID 107801255
4-chloro-N-(2-cyano-3-fluorophenyl)pyridine-2-carboxamide
CID 43580727
6-[(2-cyano-3-fluorophenyl)carbamoyl]pyridine-3-carboxylic acid
CID 43580818
2-chloro-N-(2-cyano-3-fluorophenyl)-3-fluorobenzamide
CID 79035734

Frequently Asked Questions

What is the IUPAC name of N-(2-cyano-3-fluorophenyl)-6-(methylamino)pyridine-2-carboxamide?
The IUPAC name of N-(2-cyano-3-fluorophenyl)-6-(methylamino)pyridine-2-carboxamide (CID 62240838) is N-(2-cyano-3-fluorophenyl)-6-(methylamino)pyridine-2-carboxamide.
What is the SMILES notation for N-(2-cyano-3-fluorophenyl)-6-(methylamino)pyridine-2-carboxamide?
The canonical SMILES for N-(2-cyano-3-fluorophenyl)-6-(methylamino)pyridine-2-carboxamide is CNc1cccc(C(=O)Nc2cccc(F)c2C#N)n1.
What is the InChIKey of N-(2-cyano-3-fluorophenyl)-6-(methylamino)pyridine-2-carboxamide?
The InChIKey is VGIAQXSLKSLLOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11FN4O/c1-17-13-7-3-6-12(18-13)14(20)19-11-5-2-4-10(15)9(11)8-16/h2-7H,1H3,(H,17,18)(H,19,20).
What are the key properties of N-(2-cyano-3-fluorophenyl)-6-(methylamino)pyridine-2-carboxamide?
N-(2-cyano-3-fluorophenyl)-6-(methylamino)pyridine-2-carboxamide has a molecular weight of 270.27 g/mol, XLogP of 2.39, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyano-3-fluorophenyl)-6-(methylamino)pyridine-2-carboxamide is sourced from PubChem (CID 62240838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).