N-(4-fluorophenyl)-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide

C18H14FN3O — CID 110360828

IUPACN-(4-fluorophenyl)-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide
SMILESO=C(c1cccnc1)N(Cc1cccnc1)c1ccc(F)cc1
InChIInChI=1S/C18H14FN3O/c19-16-5-7-17(8-6-16)22(13-14-3-1-9-20-11-14)18(23)15-4-2-10-21-12-15/h1-12H,13H2
InChIKeySAWVBKYDAWTFQF-UHFFFAOYSA-N
MW307.33 g/mol
LogP3.46
Rot. Bonds4

About N-(4-fluorophenyl)-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide

N-(4-fluorophenyl)-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide (PubChem CID 110360828) has the molecular formula C18H14FN3O and a molecular weight of 307.33 g/mol. Its IUPAC name is N-(4-fluorophenyl)-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide
PubChem CID110360828
Molecular FormulaC18H14FN3O
Molecular Weight307.33 g/mol
Exact Mass307.11
IUPAC NameN-(4-fluorophenyl)-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide
SMILESO=C(c1cccnc1)N(Cc1cccnc1)c1ccc(F)cc1
InChIInChI=1S/C18H14FN3O/c19-16-5-7-17(8-6-16)22(13-14-3-1-9-20-11-14)18(23)15-4-2-10-21-12-15/h1-12H,13H2
InChIKeySAWVBKYDAWTFQF-UHFFFAOYSA-N
XLogP3.46
TPSA46.09 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.33
LogP ≤ 53.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-fluorophenyl)-3-methoxy-N-(pyridin-3-ylmethyl)benzamide
CID 110360811
N-[(6-acetyl-3-pyridinyl)methyl]-N-(4-fluorophenyl)pyridine-3-carboxamide
CID 69168158
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)-N-[(6-morpholin-4-yl-3-pyridinyl)methyl]pyridine-3-carboxamide
CID 69188638
N-(4-fluorophenyl)-N-(pyridin-3-ylmethyl)pyrrolidine-1-carboxamide
CID 71938987
N-(4-fluorophenyl)-2-(6-methyl-3-pyridinyl)-N-(pyridin-3-ylmethyl)acetamide
CID 75416170
N-(4-fluorophenyl)-2-phenoxy-N-(pyridin-3-ylmethyl)acetamide
CID 13304879
N-(4-fluorophenyl)-2-(4-methoxyphenyl)-N-(pyridin-3-ylmethyl)acetamide
CID 110360820
N-benzyl-3-fluoro-N-[4-[2-oxo-2-(pyridin-3-ylmethylamino)ethyl]phenyl]benzamide
CID 46046079
N-(4-fluorophenyl)-N-(pyridin-3-ylmethyl)-3-thiophen-2-ylpropanamide
CID 110360844
3-methylsulfonyl-N-phenyl-N-(pyridin-3-ylmethyl)benzamide
CID 110619955

Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide?
The IUPAC name of N-(4-fluorophenyl)-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide (CID 110360828) is N-(4-fluorophenyl)-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide.
What is the SMILES notation for N-(4-fluorophenyl)-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide?
The canonical SMILES for N-(4-fluorophenyl)-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide is O=C(c1cccnc1)N(Cc1cccnc1)c1ccc(F)cc1.
What is the InChIKey of N-(4-fluorophenyl)-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide?
The InChIKey is SAWVBKYDAWTFQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14FN3O/c19-16-5-7-17(8-6-16)22(13-14-3-1-9-20-11-14)18(23)15-4-2-10-21-12-15/h1-12H,13H2.
What are the key properties of N-(4-fluorophenyl)-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide?
N-(4-fluorophenyl)-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide has a molecular weight of 307.33 g/mol, XLogP of 3.46, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide is sourced from PubChem (CID 110360828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).