5-(3-fluorophenyl)-N-[[6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]pyridine-2-carboxamide

C24H19FN4O — CID 56598625

IUPAC5-(3-fluorophenyl)-N-[[6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]pyridine-2-carboxamide
SMILESCc1cc(-c2ccc(CNC(=O)c3ccc(-c4cccc(F)c4)cn3)cn2)ccn1
InChIInChI=1S/C24H19FN4O/c1-16-11-19(9-10-26-16)22-7-5-17(13-27-22)14-29-24(30)23-8-6-20(15-28-23)18-3-2-4-21(25)12-18/h2-13,15H,14H2,1H3,(H,29,30)
InChIKeyOSJTWWSKFHPSMI-UHFFFAOYSA-N
MW398.44 g/mol
LogP4.58
Rot. Bonds5

About 5-(3-fluorophenyl)-N-[[6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]pyridine-2-carboxamide

5-(3-fluorophenyl)-N-[[6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]pyridine-2-carboxamide (PubChem CID 56598625) has the molecular formula C24H19FN4O and a molecular weight of 398.44 g/mol. Its IUPAC name is 5-(3-fluorophenyl)-N-[[6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name5-(3-fluorophenyl)-N-[[6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]pyridine-2-carboxamide
PubChem CID56598625
Molecular FormulaC24H19FN4O
Molecular Weight398.44 g/mol
Exact Mass398.15
IUPAC Name5-(3-fluorophenyl)-N-[[6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]pyridine-2-carboxamide
SMILESCc1cc(-c2ccc(CNC(=O)c3ccc(-c4cccc(F)c4)cn3)cn2)ccn1
InChIInChI=1S/C24H19FN4O/c1-16-11-19(9-10-26-16)22-7-5-17(13-27-22)14-29-24(30)23-8-6-20(15-28-23)18-3-2-4-21(25)12-18/h2-13,15H,14H2,1H3,(H,29,30)
InChIKeyOSJTWWSKFHPSMI-UHFFFAOYSA-N
XLogP4.58
TPSA67.77 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.44
LogP ≤ 54.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(3-acetylphenyl)-N-[[6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]pyridine-2-carboxamide
CID 66632627
N-[[6-[2-(1,1-difluoroethyl)-4-pyridinyl]-3-pyridinyl]methyl]-5-(2-methyl-3-pyridinyl)pyridine-2-carboxamide
CID 118500238
5-(3-acetylphenyl)-N-[[6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]pyridine-2-carboxamide;5-(3-cyanophenyl)-N-[[6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]pyridine-2-carboxamide;5-[3-(dimethylamino)phenyl]-N-[[6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]pyridine-2-carboxamide;5-(3-fluorophenyl)-N-[[6-(2-fluoro-4-pyridinyl)-5-methyl-3-pyridinyl]methyl]pyridine-2-carboxamide;5-(3-fluorophenyl)-N-[[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]pyridine-2-carboxamide;5-(4-fluorophenyl)-N-[[6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]pyridine-2-carboxamide;5-(3-fluorophenyl)-N-[[6-[2-(trifluoromethyl)-4-pyridinyl]-3-pyridinyl]methyl]pyridine-2-carboxamide
CID 159907883
6-[6-(dimethylamino)-3-pyridinyl]-N-[[6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]pyridine-3-carboxamide
CID 118500223
difluoromethane;N-[[6-(3-fluorophenyl)-3-pyridinyl]methyl]-6-formylpyridine-2-carboxamide;N-methylpropan-2-amine
CID 143716185
6-(3-fluorophenyl)-2-[[6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]-1H-isoquinolin-1-amine
CID 90032573
2-(3-fluorophenyl)-N-[[4-(2-methyl-4-pyridinyl)phenyl]methyl]quinoxalin-5-amine
CID 118634341
6-(3-chlorophenyl)-N-[[4-(2-methyl-4-pyridinyl)phenyl]methyl]-2,7-naphthyridin-1-amine;6-(3-fluorophenyl)-N-[[4-(2-methyl-4-pyridinyl)phenyl]methyl]-2,7-naphthyridin-1-amine;6-(3-fluorophenyl)-N-[[6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]-2,7-naphthyridin-1-amine;6-(3-fluorophenyl)-N-[[4-[2-(trifluoromethyl)-4-pyridinyl]phenyl]methyl]-2,7-naphthyridin-1-amine;N-[[4-(2-methyl-4-pyridinyl)phenyl]methyl]-6-phenyl-2,7-naphthyridin-1-amine
CID 161183960
6-(3-methylphenyl)-N-[[6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]isoquinolin-1-amine
CID 118043574
6-(3-fluorophenyl)-N-[2-[4-(2-methyl-4-pyridinyl)phenyl]ethyl]-2,7-naphthyridin-1-amine
CID 175275331
5-[4-methyl-6-[(1-methyl-2-oxo-4-pyridinyl)amino]pyrimidin-2-yl]-N-[(6-phenyl-3-pyridinyl)methyl]pyridine-2-carboxamide
CID 135256683
5-cyano-N-[(3-fluorophenyl)methyl]pyridine-2-carboxamide
CID 63718583

Frequently Asked Questions

What is the IUPAC name of 5-(3-fluorophenyl)-N-[[6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]pyridine-2-carboxamide?
The IUPAC name of 5-(3-fluorophenyl)-N-[[6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]pyridine-2-carboxamide (CID 56598625) is 5-(3-fluorophenyl)-N-[[6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]pyridine-2-carboxamide.
What is the SMILES notation for 5-(3-fluorophenyl)-N-[[6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]pyridine-2-carboxamide?
The canonical SMILES for 5-(3-fluorophenyl)-N-[[6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]pyridine-2-carboxamide is Cc1cc(-c2ccc(CNC(=O)c3ccc(-c4cccc(F)c4)cn3)cn2)ccn1.
What is the InChIKey of 5-(3-fluorophenyl)-N-[[6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]pyridine-2-carboxamide?
The InChIKey is OSJTWWSKFHPSMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19FN4O/c1-16-11-19(9-10-26-16)22-7-5-17(13-27-22)14-29-24(30)23-8-6-20(15-28-23)18-3-2-4-21(25)12-18/h2-13,15H,14H2,1H3,(H,29,30).
What are the key properties of 5-(3-fluorophenyl)-N-[[6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]pyridine-2-carboxamide?
5-(3-fluorophenyl)-N-[[6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]pyridine-2-carboxamide has a molecular weight of 398.44 g/mol, XLogP of 4.58, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-fluorophenyl)-N-[[6-(2-methyl-4-pyridinyl)-3-pyridinyl]methyl]pyridine-2-carboxamide is sourced from PubChem (CID 56598625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).