2-(4-fluorophenyl)-3-pyridin-2-yl-N-(pyridin-3-ylmethyl)propanamide

C20H18FN3O — CID 110296305

IUPAC2-(4-fluorophenyl)-3-pyridin-2-yl-N-(pyridin-3-ylmethyl)propanamide
SMILESO=C(NCc1cccnc1)C(Cc1ccccn1)c1ccc(F)cc1
InChIInChI=1S/C20H18FN3O/c21-17-8-6-16(7-9-17)19(12-18-5-1-2-11-23-18)20(25)24-14-15-4-3-10-22-13-15/h1-11,13,19H,12,14H2,(H,24,25)
InChIKeyZXILOFJJHGWJLL-UHFFFAOYSA-N
MW335.38 g/mol
LogP3.26
Rot. Bonds6

About 2-(4-fluorophenyl)-3-pyridin-2-yl-N-(pyridin-3-ylmethyl)propanamide

2-(4-fluorophenyl)-3-pyridin-2-yl-N-(pyridin-3-ylmethyl)propanamide (PubChem CID 110296305) has the molecular formula C20H18FN3O and a molecular weight of 335.38 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-3-pyridin-2-yl-N-(pyridin-3-ylmethyl)propanamide.

Molecular Properties

Compound Name2-(4-fluorophenyl)-3-pyridin-2-yl-N-(pyridin-3-ylmethyl)propanamide
PubChem CID110296305
Molecular FormulaC20H18FN3O
Molecular Weight335.38 g/mol
Exact Mass335.14
IUPAC Name2-(4-fluorophenyl)-3-pyridin-2-yl-N-(pyridin-3-ylmethyl)propanamide
SMILESO=C(NCc1cccnc1)C(Cc1ccccn1)c1ccc(F)cc1
InChIInChI=1S/C20H18FN3O/c21-17-8-6-16(7-9-17)19(12-18-5-1-2-11-23-18)20(25)24-14-15-4-3-10-22-13-15/h1-11,13,19H,12,14H2,(H,24,25)
InChIKeyZXILOFJJHGWJLL-UHFFFAOYSA-N
XLogP3.26
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.38
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-fluorophenyl)-N-[(2-fluorophenyl)methyl]-3-pyridin-2-ylpropanamide
CID 110296296
N-[(4-fluorophenyl)methyl]-2-phenyl-3-pyridin-3-ylpropanamide
CID 110409718
2-(4-fluorophenyl)-N-propyl-3-pyridin-2-ylpropanamide
CID 110296265
2-phenyl-3-pyridin-2-yl-N-(pyridin-2-ylmethyl)propanamide
CID 110410528
2-(4-chlorophenyl)-3-pyridin-2-yl-N-(pyridin-4-ylmethyl)propanamide
CID 110296687
N-[(3,4-dimethoxyphenyl)methyl]-2-(4-fluorophenyl)-3-pyridin-3-ylpropanamide
CID 110296450
N-[2-(diethylamino)propyl]-2-(4-fluorophenyl)-3-pyridin-2-ylpropanamide
CID 110301478
2-(4-chlorophenyl)-N-[(4-methylphenyl)methyl]-3-pyridin-2-ylpropanamide
CID 110296675
2-phenyl-3-pyridin-4-yl-N-(pyridin-2-ylmethyl)propanamide
CID 110410530
2-(4-fluorophenyl)-3-pyridin-3-yl-N-[2-(1,3-thiazol-4-yl)ethyl]propanamide
CID 110305024
2-(4-fluorophenyl)-N-(2-methylphenyl)-3-pyridin-2-ylpropanamide
CID 110296341
N-(2-chlorophenyl)-2-(4-fluorophenyl)-3-pyridin-2-ylpropanamide
CID 110296355

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-3-pyridin-2-yl-N-(pyridin-3-ylmethyl)propanamide?
The IUPAC name of 2-(4-fluorophenyl)-3-pyridin-2-yl-N-(pyridin-3-ylmethyl)propanamide (CID 110296305) is 2-(4-fluorophenyl)-3-pyridin-2-yl-N-(pyridin-3-ylmethyl)propanamide.
What is the SMILES notation for 2-(4-fluorophenyl)-3-pyridin-2-yl-N-(pyridin-3-ylmethyl)propanamide?
The canonical SMILES for 2-(4-fluorophenyl)-3-pyridin-2-yl-N-(pyridin-3-ylmethyl)propanamide is O=C(NCc1cccnc1)C(Cc1ccccn1)c1ccc(F)cc1.
What is the InChIKey of 2-(4-fluorophenyl)-3-pyridin-2-yl-N-(pyridin-3-ylmethyl)propanamide?
The InChIKey is ZXILOFJJHGWJLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18FN3O/c21-17-8-6-16(7-9-17)19(12-18-5-1-2-11-23-18)20(25)24-14-15-4-3-10-22-13-15/h1-11,13,19H,12,14H2,(H,24,25).
What are the key properties of 2-(4-fluorophenyl)-3-pyridin-2-yl-N-(pyridin-3-ylmethyl)propanamide?
2-(4-fluorophenyl)-3-pyridin-2-yl-N-(pyridin-3-ylmethyl)propanamide has a molecular weight of 335.38 g/mol, XLogP of 3.26, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-3-pyridin-2-yl-N-(pyridin-3-ylmethyl)propanamide is sourced from PubChem (CID 110296305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).