4-(3,4-difluorophenyl)-4-oxo-N-piperidin-4-yl-N-propylbutanamide

C18H24F2N2O2 — CID 119824265

IUPAC4-(3,4-difluorophenyl)-4-oxo-N-piperidin-4-yl-N-propylbutanamide
SMILESCCCN(C(=O)CCC(=O)c1ccc(F)c(F)c1)C1CCNCC1
InChIInChI=1S/C18H24F2N2O2/c1-2-11-22(14-7-9-21-10-8-14)18(24)6-5-17(23)13-3-4-15(19)16(20)12-13/h3-4,12,14,21H,2,5-11H2,1H3
InChIKeyNLHFFZBRKFVMSQ-UHFFFAOYSA-N
MW338.40 g/mol
LogP2.92
Rot. Bonds7

About 4-(3,4-difluorophenyl)-4-oxo-N-piperidin-4-yl-N-propylbutanamide

4-(3,4-difluorophenyl)-4-oxo-N-piperidin-4-yl-N-propylbutanamide (PubChem CID 119824265) has the molecular formula C18H24F2N2O2 and a molecular weight of 338.40 g/mol. Its IUPAC name is 4-(3,4-difluorophenyl)-4-oxo-N-piperidin-4-yl-N-propylbutanamide.

Molecular Properties

Compound Name4-(3,4-difluorophenyl)-4-oxo-N-piperidin-4-yl-N-propylbutanamide
PubChem CID119824265
Molecular FormulaC18H24F2N2O2
Molecular Weight338.40 g/mol
Exact Mass338.18
IUPAC Name4-(3,4-difluorophenyl)-4-oxo-N-piperidin-4-yl-N-propylbutanamide
SMILESCCCN(C(=O)CCC(=O)c1ccc(F)c(F)c1)C1CCNCC1
InChIInChI=1S/C18H24F2N2O2/c1-2-11-22(14-7-9-21-10-8-14)18(24)6-5-17(23)13-3-4-15(19)16(20)12-13/h3-4,12,14,21H,2,5-11H2,1H3
InChIKeyNLHFFZBRKFVMSQ-UHFFFAOYSA-N
XLogP2.92
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.40
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-(3,4-difluorophenyl)-4-oxo-N-piperidin-4-yl-N-propylbutanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(3,4-difluorophenyl)-N-piperidin-4-yl-N-propylbutanamide
CID 119824702
3-fluoro-4-iodo-N-piperidin-4-yl-N-propylbenzamide
CID 119825905
(3,4-difluorophenyl)methyl N-piperidin-4-yl-N-propylcarbamate
CID 18677719
3-(2,5-difluorophenyl)-N-propyl-N-pyrrolidin-3-ylpropanamide;hydrochloride
CID 119532213
(3,4-difluorophenyl)methyl N-piperidin-4-yl-N-propylcarbamate;hydrochloride
CID 18677718
3-(4-chlorophenyl)sulfanyl-N-piperidin-4-yl-N-propylpropanamide;hydrochloride
CID 119824335
N-piperidin-4-yl-N-propylhexanamide
CID 60807623
2-(3-chloro-4-fluorophenoxy)-N-piperidin-4-yl-N-propylacetamide
CID 119824506
3-[3-(4-fluoro-3-methylphenyl)-1,2,4-oxadiazol-5-yl]-N-piperidin-4-yl-N-propylpropanamide
CID 119825840
3-(2,4-dichlorophenoxy)-N-piperidin-4-yl-N-propylpropanamide;hydrochloride
CID 119825395
3-[3-(4-fluoro-3-methylphenyl)-1,2,4-oxadiazol-5-yl]-N-piperidin-4-yl-N-propylpropanamide;hydrochloride
CID 119825839
2-(2,4-difluorophenoxy)-N-piperidin-4-yl-N-propylacetamide;hydrochloride
CID 119824020

Frequently Asked Questions

What is the IUPAC name of 4-(3,4-difluorophenyl)-4-oxo-N-piperidin-4-yl-N-propylbutanamide?
The IUPAC name of 4-(3,4-difluorophenyl)-4-oxo-N-piperidin-4-yl-N-propylbutanamide (CID 119824265) is 4-(3,4-difluorophenyl)-4-oxo-N-piperidin-4-yl-N-propylbutanamide.
What is the SMILES notation for 4-(3,4-difluorophenyl)-4-oxo-N-piperidin-4-yl-N-propylbutanamide?
The canonical SMILES for 4-(3,4-difluorophenyl)-4-oxo-N-piperidin-4-yl-N-propylbutanamide is CCCN(C(=O)CCC(=O)c1ccc(F)c(F)c1)C1CCNCC1.
What is the InChIKey of 4-(3,4-difluorophenyl)-4-oxo-N-piperidin-4-yl-N-propylbutanamide?
The InChIKey is NLHFFZBRKFVMSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24F2N2O2/c1-2-11-22(14-7-9-21-10-8-14)18(24)6-5-17(23)13-3-4-15(19)16(20)12-13/h3-4,12,14,21H,2,5-11H2,1H3.
What are the key properties of 4-(3,4-difluorophenyl)-4-oxo-N-piperidin-4-yl-N-propylbutanamide?
4-(3,4-difluorophenyl)-4-oxo-N-piperidin-4-yl-N-propylbutanamide has a molecular weight of 338.40 g/mol, XLogP of 2.92, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,4-difluorophenyl)-4-oxo-N-piperidin-4-yl-N-propylbutanamide is sourced from PubChem (CID 119824265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).