N-[(3-fluorophenyl)methyl]-6-pyridin-3-ylpyridine-3-carboxamide

C18H14FN3O — CID 71841647

IUPACN-[(3-fluorophenyl)methyl]-6-pyridin-3-ylpyridine-3-carboxamide
SMILESO=C(NCc1cccc(F)c1)c1ccc(-c2cccnc2)nc1
InChIInChI=1S/C18H14FN3O/c19-16-5-1-3-13(9-16)10-22-18(23)15-6-7-17(21-12-15)14-4-2-8-20-11-14/h1-9,11-12H,10H2,(H,22,23)
InChIKeyJQARNEAIQJCBKS-UHFFFAOYSA-N
MW307.33 g/mol
LogP3.21
Rot. Bonds4

About N-[(3-fluorophenyl)methyl]-6-pyridin-3-ylpyridine-3-carboxamide

N-[(3-fluorophenyl)methyl]-6-pyridin-3-ylpyridine-3-carboxamide (PubChem CID 71841647) has the molecular formula C18H14FN3O and a molecular weight of 307.33 g/mol. Its IUPAC name is N-[(3-fluorophenyl)methyl]-6-pyridin-3-ylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-[(3-fluorophenyl)methyl]-6-pyridin-3-ylpyridine-3-carboxamide
PubChem CID71841647
Molecular FormulaC18H14FN3O
Molecular Weight307.33 g/mol
Exact Mass307.11
IUPAC NameN-[(3-fluorophenyl)methyl]-6-pyridin-3-ylpyridine-3-carboxamide
SMILESO=C(NCc1cccc(F)c1)c1ccc(-c2cccnc2)nc1
InChIInChI=1S/C18H14FN3O/c19-16-5-1-3-13(9-16)10-22-18(23)15-6-7-17(21-12-15)14-4-2-8-20-11-14/h1-9,11-12H,10H2,(H,22,23)
InChIKeyJQARNEAIQJCBKS-UHFFFAOYSA-N
XLogP3.21
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.33
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(4-chlorophenyl)methyl]-6-pyridin-3-ylpyridine-3-carboxamide
CID 71841638
N-[(4-methylphenyl)methyl]-6-pyridin-3-ylpyridine-3-carboxamide
CID 53149733
6-chloro-N-[(3-fluorophenyl)methyl]pyridine-3-carboxamide
CID 24903422
N-ethyl-6-pyridin-3-ylpyridine-3-carboxamide
CID 141194620
N-[(3-fluorophenyl)methyl]-6-hydrazinylpyridine-3-carboxamide
CID 62243829
N-[(3-chlorophenyl)methyl]-6-pyrimidin-5-ylpyridine-3-carboxamide
CID 91634104
6-(2-fluoro-4-methylphenyl)-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide
CID 153360760
6-bromo-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide
CID 66463466
2-N,4-N-bis[(3-fluorophenyl)methyl]pyridine-2,4-dicarboxamide
CID 10293185
N-[(3-chloro-4-fluorophenyl)methyl]-6-pyrimidin-5-ylpyridine-3-carboxamide
CID 71841602
N-[(2,3-dimethoxyphenyl)methyl]-6-pyridin-3-ylpyridine-3-carboxamide
CID 53149720
N-benzyl-5-(3-fluorophenyl)pyridine-3-carboxamide
CID 42845762

Frequently Asked Questions

What is the IUPAC name of N-[(3-fluorophenyl)methyl]-6-pyridin-3-ylpyridine-3-carboxamide?
The IUPAC name of N-[(3-fluorophenyl)methyl]-6-pyridin-3-ylpyridine-3-carboxamide (CID 71841647) is N-[(3-fluorophenyl)methyl]-6-pyridin-3-ylpyridine-3-carboxamide.
What is the SMILES notation for N-[(3-fluorophenyl)methyl]-6-pyridin-3-ylpyridine-3-carboxamide?
The canonical SMILES for N-[(3-fluorophenyl)methyl]-6-pyridin-3-ylpyridine-3-carboxamide is O=C(NCc1cccc(F)c1)c1ccc(-c2cccnc2)nc1.
What is the InChIKey of N-[(3-fluorophenyl)methyl]-6-pyridin-3-ylpyridine-3-carboxamide?
The InChIKey is JQARNEAIQJCBKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14FN3O/c19-16-5-1-3-13(9-16)10-22-18(23)15-6-7-17(21-12-15)14-4-2-8-20-11-14/h1-9,11-12H,10H2,(H,22,23).
What are the key properties of N-[(3-fluorophenyl)methyl]-6-pyridin-3-ylpyridine-3-carboxamide?
N-[(3-fluorophenyl)methyl]-6-pyridin-3-ylpyridine-3-carboxamide has a molecular weight of 307.33 g/mol, XLogP of 3.21, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-fluorophenyl)methyl]-6-pyridin-3-ylpyridine-3-carboxamide is sourced from PubChem (CID 71841647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).