2-(3-fluorophenyl)-N-piperidin-4-yl-N-propylpropanamide

C17H25FN2O — CID 119823341

IUPAC2-(3-fluorophenyl)-N-piperidin-4-yl-N-propylpropanamide
SMILESCCCN(C(=O)C(C)c1cccc(F)c1)C1CCNCC1
InChIInChI=1S/C17H25FN2O/c1-3-11-20(16-7-9-19-10-8-16)17(21)13(2)14-5-4-6-15(18)12-14/h4-6,12-13,16,19H,3,7-11H2,1-2H3
InChIKeyHQDAZYRZKFPKSU-UHFFFAOYSA-N
MW292.40 g/mol
LogP2.92
Rot. Bonds5

About 2-(3-fluorophenyl)-N-piperidin-4-yl-N-propylpropanamide

2-(3-fluorophenyl)-N-piperidin-4-yl-N-propylpropanamide (PubChem CID 119823341) has the molecular formula C17H25FN2O and a molecular weight of 292.40 g/mol. Its IUPAC name is 2-(3-fluorophenyl)-N-piperidin-4-yl-N-propylpropanamide.

Molecular Properties

Compound Name2-(3-fluorophenyl)-N-piperidin-4-yl-N-propylpropanamide
PubChem CID119823341
Molecular FormulaC17H25FN2O
Molecular Weight292.40 g/mol
Exact Mass292.20
IUPAC Name2-(3-fluorophenyl)-N-piperidin-4-yl-N-propylpropanamide
SMILESCCCN(C(=O)C(C)c1cccc(F)c1)C1CCNCC1
InChIInChI=1S/C17H25FN2O/c1-3-11-20(16-7-9-19-10-8-16)17(21)13(2)14-5-4-6-15(18)12-14/h4-6,12-13,16,19H,3,7-11H2,1-2H3
InChIKeyHQDAZYRZKFPKSU-UHFFFAOYSA-N
XLogP2.92
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.40
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-propyl-2-pyridin-3-yl-N-pyrrolidin-3-ylpropanamide
CID 119530488
(Z)-3-(3-fluorophenyl)-N-piperidin-4-yl-N-propylbut-2-enamide;hydrochloride
CID 102560206
2-(2-bromo-4-fluorophenoxy)-N-piperidin-4-yl-N-propylpropanamide;hydrochloride
CID 119824478
3-(3-fluorophenyl)-N,2-dimethyl-N-piperidin-4-ylpropanamide
CID 119443185
3-phenyl-N-piperidin-4-yl-N-propylbutanamide;hydrochloride
CID 119824337
2-methyl-N-piperidin-4-yl-N-propyl-3-[4-(trifluoromethyl)phenyl]propanamide
CID 119823787
3-(4-fluorophenyl)sulfanyl-2-methyl-N-propyl-N-pyrrolidin-3-ylpropanamide
CID 119530613
N-ethyl-2-(3-fluorophenyl)-N-(2-hydroxyethyl)propanamide
CID 109468131
2-phenyl-N-propyl-N-pyrrolidin-3-ylbutanamide;hydrochloride
CID 120607586
(3,5-difluorophenyl)methyl N-piperidin-4-yl-N-propylcarbamate
CID 18677668
3-(2-fluorophenyl)-2-methyl-N-propyl-N-pyrrolidin-3-ylpropanamide
CID 119532764
3-[piperidin-4-yl(propyl)carbamoyl]benzoic acid
CID 61408528

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluorophenyl)-N-piperidin-4-yl-N-propylpropanamide?
The IUPAC name of 2-(3-fluorophenyl)-N-piperidin-4-yl-N-propylpropanamide (CID 119823341) is 2-(3-fluorophenyl)-N-piperidin-4-yl-N-propylpropanamide.
What is the SMILES notation for 2-(3-fluorophenyl)-N-piperidin-4-yl-N-propylpropanamide?
The canonical SMILES for 2-(3-fluorophenyl)-N-piperidin-4-yl-N-propylpropanamide is CCCN(C(=O)C(C)c1cccc(F)c1)C1CCNCC1.
What is the InChIKey of 2-(3-fluorophenyl)-N-piperidin-4-yl-N-propylpropanamide?
The InChIKey is HQDAZYRZKFPKSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25FN2O/c1-3-11-20(16-7-9-19-10-8-16)17(21)13(2)14-5-4-6-15(18)12-14/h4-6,12-13,16,19H,3,7-11H2,1-2H3.
What are the key properties of 2-(3-fluorophenyl)-N-piperidin-4-yl-N-propylpropanamide?
2-(3-fluorophenyl)-N-piperidin-4-yl-N-propylpropanamide has a molecular weight of 292.40 g/mol, XLogP of 2.92, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluorophenyl)-N-piperidin-4-yl-N-propylpropanamide is sourced from PubChem (CID 119823341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).