2-(4-fluorophenyl)-N-(2-methyl-2-pyrrolidin-1-ylpropyl)-3-pyridin-2-ylpropanamide

C22H28FN3O — CID 110303116

IUPAC2-(4-fluorophenyl)-N-(2-methyl-2-pyrrolidin-1-ylpropyl)-3-pyridin-2-ylpropanamide
SMILESCC(C)(CNC(=O)C(Cc1ccccn1)c1ccc(F)cc1)N1CCCC1
InChIInChI=1S/C22H28FN3O/c1-22(2,26-13-5-6-14-26)16-25-21(27)20(15-19-7-3-4-12-24-19)17-8-10-18(23)11-9-17/h3-4,7-12,20H,5-6,13-16H2,1-2H3,(H,25,27)
InChIKeyAUVPMKJOWFSYON-UHFFFAOYSA-N
MW369.48 g/mol
LogP3.54
Rot. Bonds7

About 2-(4-fluorophenyl)-N-(2-methyl-2-pyrrolidin-1-ylpropyl)-3-pyridin-2-ylpropanamide

2-(4-fluorophenyl)-N-(2-methyl-2-pyrrolidin-1-ylpropyl)-3-pyridin-2-ylpropanamide (PubChem CID 110303116) has the molecular formula C22H28FN3O and a molecular weight of 369.48 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-N-(2-methyl-2-pyrrolidin-1-ylpropyl)-3-pyridin-2-ylpropanamide.

Molecular Properties

Compound Name2-(4-fluorophenyl)-N-(2-methyl-2-pyrrolidin-1-ylpropyl)-3-pyridin-2-ylpropanamide
PubChem CID110303116
Molecular FormulaC22H28FN3O
Molecular Weight369.48 g/mol
Exact Mass369.22
IUPAC Name2-(4-fluorophenyl)-N-(2-methyl-2-pyrrolidin-1-ylpropyl)-3-pyridin-2-ylpropanamide
SMILESCC(C)(CNC(=O)C(Cc1ccccn1)c1ccc(F)cc1)N1CCCC1
InChIInChI=1S/C22H28FN3O/c1-22(2,26-13-5-6-14-26)16-25-21(27)20(15-19-7-3-4-12-24-19)17-8-10-18(23)11-9-17/h3-4,7-12,20H,5-6,13-16H2,1-2H3,(H,25,27)
InChIKeyAUVPMKJOWFSYON-UHFFFAOYSA-N
XLogP3.54
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.48
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-fluorophenyl)-N-propyl-3-pyridin-2-ylpropanamide
CID 110296265
2-(4-fluorophenyl)-N-[(2-fluorophenyl)methyl]-3-pyridin-2-ylpropanamide
CID 110296296
2-(4-fluorophenyl)-3-methyl-N-(2-methyl-2-pyrrolidin-1-ylpropyl)butanamide
CID 110312935
N-(2-oxo-2-piperidin-1-ylethyl)-2-phenyl-3-pyridin-2-ylpropanamide
CID 110633466
N-[2-(diethylamino)propyl]-2-(4-fluorophenyl)-3-pyridin-2-ylpropanamide
CID 110301478
N-(2-chlorophenyl)-2-(4-fluorophenyl)-3-pyridin-2-ylpropanamide
CID 110296355
2-(4-fluorophenyl)-3-pyridin-2-yl-N-(pyridin-3-ylmethyl)propanamide
CID 110296305
2-phenyl-3-pyridin-2-yl-N-(pyridin-2-ylmethyl)propanamide
CID 110410528
2-(4-fluorophenyl)-N-(2-methylphenyl)-3-pyridin-2-ylpropanamide
CID 110296341
2-methyl-N-(2-methyl-2-pyrrolidin-1-ylpropyl)-3-phenylpropanamide
CID 110353481
N-(3-chlorophenyl)-2-(4-fluorophenyl)-3-pyridin-2-ylpropanamide
CID 110296356
2-(4-fluorophenyl)-1-[4-(5-methyl-1,3,4-oxadiazol-2-yl)piperazin-1-yl]-3-pyridin-2-ylpropan-1-one
CID 110417211

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-N-(2-methyl-2-pyrrolidin-1-ylpropyl)-3-pyridin-2-ylpropanamide?
The IUPAC name of 2-(4-fluorophenyl)-N-(2-methyl-2-pyrrolidin-1-ylpropyl)-3-pyridin-2-ylpropanamide (CID 110303116) is 2-(4-fluorophenyl)-N-(2-methyl-2-pyrrolidin-1-ylpropyl)-3-pyridin-2-ylpropanamide.
What is the SMILES notation for 2-(4-fluorophenyl)-N-(2-methyl-2-pyrrolidin-1-ylpropyl)-3-pyridin-2-ylpropanamide?
The canonical SMILES for 2-(4-fluorophenyl)-N-(2-methyl-2-pyrrolidin-1-ylpropyl)-3-pyridin-2-ylpropanamide is CC(C)(CNC(=O)C(Cc1ccccn1)c1ccc(F)cc1)N1CCCC1.
What is the InChIKey of 2-(4-fluorophenyl)-N-(2-methyl-2-pyrrolidin-1-ylpropyl)-3-pyridin-2-ylpropanamide?
The InChIKey is AUVPMKJOWFSYON-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28FN3O/c1-22(2,26-13-5-6-14-26)16-25-21(27)20(15-19-7-3-4-12-24-19)17-8-10-18(23)11-9-17/h3-4,7-12,20H,5-6,13-16H2,1-2H3,(H,25,27).
What are the key properties of 2-(4-fluorophenyl)-N-(2-methyl-2-pyrrolidin-1-ylpropyl)-3-pyridin-2-ylpropanamide?
2-(4-fluorophenyl)-N-(2-methyl-2-pyrrolidin-1-ylpropyl)-3-pyridin-2-ylpropanamide has a molecular weight of 369.48 g/mol, XLogP of 3.54, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-N-(2-methyl-2-pyrrolidin-1-ylpropyl)-3-pyridin-2-ylpropanamide is sourced from PubChem (CID 110303116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).