N-(4-cyanophenyl)-6-[2-(4-fluorophenyl)ethylamino]pyridine-3-carboxamide

C21H17FN4O — CID 109158680

IUPACN-(4-cyanophenyl)-6-[2-(4-fluorophenyl)ethylamino]pyridine-3-carboxamide
SMILESN#Cc1ccc(NC(=O)c2ccc(NCCc3ccc(F)cc3)nc2)cc1
InChIInChI=1S/C21H17FN4O/c22-18-6-1-15(2-7-18)11-12-24-20-10-5-17(14-25-20)21(27)26-19-8-3-16(13-23)4-9-19/h1-10,14H,11-12H2,(H,24,25)(H,26,27)
InChIKeyIWOWIWXVVLAUOV-UHFFFAOYSA-N
MW360.39 g/mol
LogP4.00
Rot. Bonds6

About N-(4-cyanophenyl)-6-[2-(4-fluorophenyl)ethylamino]pyridine-3-carboxamide

N-(4-cyanophenyl)-6-[2-(4-fluorophenyl)ethylamino]pyridine-3-carboxamide (PubChem CID 109158680) has the molecular formula C21H17FN4O and a molecular weight of 360.39 g/mol. Its IUPAC name is N-(4-cyanophenyl)-6-[2-(4-fluorophenyl)ethylamino]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(4-cyanophenyl)-6-[2-(4-fluorophenyl)ethylamino]pyridine-3-carboxamide
PubChem CID109158680
Molecular FormulaC21H17FN4O
Molecular Weight360.39 g/mol
Exact Mass360.14
IUPAC NameN-(4-cyanophenyl)-6-[2-(4-fluorophenyl)ethylamino]pyridine-3-carboxamide
SMILESN#Cc1ccc(NC(=O)c2ccc(NCCc3ccc(F)cc3)nc2)cc1
InChIInChI=1S/C21H17FN4O/c22-18-6-1-15(2-7-18)11-12-24-20-10-5-17(14-25-20)21(27)26-19-8-3-16(13-23)4-9-19/h1-10,14H,11-12H2,(H,24,25)(H,26,27)
InChIKeyIWOWIWXVVLAUOV-UHFFFAOYSA-N
XLogP4.00
TPSA77.81 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.39
LogP ≤ 54.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-(dimethylamino)phenyl]-6-[2-(4-fluorophenyl)ethylamino]pyridine-3-carboxamide
CID 109158671
N-(4-fluorophenyl)-5-[2-(4-fluorophenyl)ethylamino]pyrazine-2-carboxamide
CID 109284544
N-(4-fluorophenyl)-6-[2-(2-methoxyphenyl)ethylamino]pyridine-3-carboxamide
CID 109158776
N-cycloheptyl-6-[2-(4-fluorophenyl)ethylamino]pyridine-3-carboxamide
CID 109158626
N-(4-acetylphenyl)-5-[2-(4-fluorophenyl)ethylamino]pyrazine-2-carboxamide
CID 109284566
N-(2,5-dimethoxyphenyl)-6-[2-(4-fluorophenyl)ethylamino]pyridine-3-carboxamide
CID 109158661
6-[2-(4-fluorophenyl)ethylamino]-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide
CID 109158658
N-(4-acetamidophenyl)-6-(4-cyanoanilino)pyridine-3-carboxamide
CID 109164577
6-[2-(4-fluorophenyl)ethylamino]-N,N-dimethylpyridine-3-carboxamide
CID 78956160
N-(4-chlorophenyl)-6-[2-(4-methoxyphenyl)ethylamino]pyridine-3-carboxamide
CID 109159015
N-[4-(dimethylamino)phenyl]-6-[(4-fluorophenyl)methylamino]pyridine-3-carboxamide
CID 109156661
6-(4-bromoanilino)-N-(4-cyanophenyl)pyridine-3-carboxamide
CID 109163836

Frequently Asked Questions

What is the IUPAC name of N-(4-cyanophenyl)-6-[2-(4-fluorophenyl)ethylamino]pyridine-3-carboxamide?
The IUPAC name of N-(4-cyanophenyl)-6-[2-(4-fluorophenyl)ethylamino]pyridine-3-carboxamide (CID 109158680) is N-(4-cyanophenyl)-6-[2-(4-fluorophenyl)ethylamino]pyridine-3-carboxamide.
What is the SMILES notation for N-(4-cyanophenyl)-6-[2-(4-fluorophenyl)ethylamino]pyridine-3-carboxamide?
The canonical SMILES for N-(4-cyanophenyl)-6-[2-(4-fluorophenyl)ethylamino]pyridine-3-carboxamide is N#Cc1ccc(NC(=O)c2ccc(NCCc3ccc(F)cc3)nc2)cc1.
What is the InChIKey of N-(4-cyanophenyl)-6-[2-(4-fluorophenyl)ethylamino]pyridine-3-carboxamide?
The InChIKey is IWOWIWXVVLAUOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17FN4O/c22-18-6-1-15(2-7-18)11-12-24-20-10-5-17(14-25-20)21(27)26-19-8-3-16(13-23)4-9-19/h1-10,14H,11-12H2,(H,24,25)(H,26,27).
What are the key properties of N-(4-cyanophenyl)-6-[2-(4-fluorophenyl)ethylamino]pyridine-3-carboxamide?
N-(4-cyanophenyl)-6-[2-(4-fluorophenyl)ethylamino]pyridine-3-carboxamide has a molecular weight of 360.39 g/mol, XLogP of 4.00, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-cyanophenyl)-6-[2-(4-fluorophenyl)ethylamino]pyridine-3-carboxamide is sourced from PubChem (CID 109158680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).