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

C20H16FN3O2 — CID 69168158

IUPACN-[(6-acetyl-3-pyridinyl)methyl]-N-(4-fluorophenyl)pyridine-3-carboxamide
SMILESCC(=O)c1ccc(CN(C(=O)c2cccnc2)c2ccc(F)cc2)cn1
InChIInChI=1S/C20H16FN3O2/c1-14(25)19-9-4-15(11-23-19)13-24(18-7-5-17(21)6-8-18)20(26)16-3-2-10-22-12-16/h2-12H,13H2,1H3
InChIKeyOXEJDQCZKWXTOC-UHFFFAOYSA-N
MW349.37 g/mol
LogP3.67
Rot. Bonds5

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

N-[(6-acetyl-3-pyridinyl)methyl]-N-(4-fluorophenyl)pyridine-3-carboxamide (PubChem CID 69168158) has the molecular formula C20H16FN3O2 and a molecular weight of 349.37 g/mol. Its IUPAC name is N-[(6-acetyl-3-pyridinyl)methyl]-N-(4-fluorophenyl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[(6-acetyl-3-pyridinyl)methyl]-N-(4-fluorophenyl)pyridine-3-carboxamide
PubChem CID69168158
Molecular FormulaC20H16FN3O2
Molecular Weight349.37 g/mol
Exact Mass349.12
IUPAC NameN-[(6-acetyl-3-pyridinyl)methyl]-N-(4-fluorophenyl)pyridine-3-carboxamide
SMILESCC(=O)c1ccc(CN(C(=O)c2cccnc2)c2ccc(F)cc2)cn1
InChIInChI=1S/C20H16FN3O2/c1-14(25)19-9-4-15(11-23-19)13-24(18-7-5-17(21)6-8-18)20(26)16-3-2-10-22-12-16/h2-12H,13H2,1H3
InChIKeyOXEJDQCZKWXTOC-UHFFFAOYSA-N
XLogP3.67
TPSA63.16 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.37
LogP ≤ 53.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-[(6-acetyl-3-pyridinyl)methyl]-N-(4-fluorophenyl)pyridine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(4-fluorophenyl)-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide
CID 110360828
N-(4-fluorophenyl)-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]pyridine-3-carboxamide
CID 69188638
N-(4-fluorophenyl)-3-methoxy-N-(pyridin-3-ylmethyl)benzamide
CID 110360811
N-(4-fluorophenyl)-2-(6-methyl-3-pyridinyl)-N-(pyridin-3-ylmethyl)acetamide
CID 75416170
N-benzyl-N-phenylpyridine-3-carboxamide;hydrochloride
CID 110756627
N-(3,5-dimethylphenyl)-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide
CID 110360894
N-(4-fluorophenyl)-2-(4-methoxyphenyl)-N-(pyridin-3-ylmethyl)acetamide
CID 110360820
N-(4-fluorophenyl)-2-phenoxy-N-(pyridin-3-ylmethyl)acetamide
CID 13304879
N-(4-fluorophenyl)-2,2-dimethyl-N-[[6-[methyl(2-pyridin-3-ylethyl)amino]-3-pyridinyl]methyl]propanamide
CID 24990087
N-benzyl-3-fluoro-N-[4-[2-oxo-2-(pyridin-3-ylmethylamino)ethyl]phenyl]benzamide
CID 46046079
N-(4-fluorophenyl)-N-(pyridin-3-ylmethyl)pyrrolidine-1-carboxamide
CID 71938987
3-methylsulfonyl-N-phenyl-N-(pyridin-3-ylmethyl)benzamide
CID 110619955

Frequently Asked Questions

What is the IUPAC name of N-[(6-acetyl-3-pyridinyl)methyl]-N-(4-fluorophenyl)pyridine-3-carboxamide?
The IUPAC name of N-[(6-acetyl-3-pyridinyl)methyl]-N-(4-fluorophenyl)pyridine-3-carboxamide (CID 69168158) is N-[(6-acetyl-3-pyridinyl)methyl]-N-(4-fluorophenyl)pyridine-3-carboxamide.
What is the SMILES notation for N-[(6-acetyl-3-pyridinyl)methyl]-N-(4-fluorophenyl)pyridine-3-carboxamide?
The canonical SMILES for N-[(6-acetyl-3-pyridinyl)methyl]-N-(4-fluorophenyl)pyridine-3-carboxamide is CC(=O)c1ccc(CN(C(=O)c2cccnc2)c2ccc(F)cc2)cn1.
What is the InChIKey of N-[(6-acetyl-3-pyridinyl)methyl]-N-(4-fluorophenyl)pyridine-3-carboxamide?
The InChIKey is OXEJDQCZKWXTOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16FN3O2/c1-14(25)19-9-4-15(11-23-19)13-24(18-7-5-17(21)6-8-18)20(26)16-3-2-10-22-12-16/h2-12H,13H2,1H3.
What are the key properties of N-[(6-acetyl-3-pyridinyl)methyl]-N-(4-fluorophenyl)pyridine-3-carboxamide?
N-[(6-acetyl-3-pyridinyl)methyl]-N-(4-fluorophenyl)pyridine-3-carboxamide has a molecular weight of 349.37 g/mol, XLogP of 3.67, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-acetyl-3-pyridinyl)methyl]-N-(4-fluorophenyl)pyridine-3-carboxamide is sourced from PubChem (CID 69168158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).