N,N-diethyl-1-[(2-fluorophenyl)methyl]piperidine-4-carboxamide

C17H25FN2O — CID 1076485

IUPACN,N-diethyl-1-[(2-fluorophenyl)methyl]piperidine-4-carboxamide
SMILESCCN(CC)C(=O)C1CCN(Cc2ccccc2F)CC1
InChIInChI=1S/C17H25FN2O/c1-3-20(4-2)17(21)14-9-11-19(12-10-14)13-15-7-5-6-8-16(15)18/h5-8,14H,3-4,9-13H2,1-2H3
InChIKeyGAOGKMGPFNCBTP-UHFFFAOYSA-N
MW292.40 g/mol
LogP2.91
Rot. Bonds5

About N,N-diethyl-1-[(2-fluorophenyl)methyl]piperidine-4-carboxamide

N,N-diethyl-1-[(2-fluorophenyl)methyl]piperidine-4-carboxamide (PubChem CID 1076485) has the molecular formula C17H25FN2O and a molecular weight of 292.40 g/mol. Its IUPAC name is N,N-diethyl-1-[(2-fluorophenyl)methyl]piperidine-4-carboxamide.

Molecular Properties

Compound NameN,N-diethyl-1-[(2-fluorophenyl)methyl]piperidine-4-carboxamide
PubChem CID1076485
Molecular FormulaC17H25FN2O
Molecular Weight292.40 g/mol
Exact Mass292.20
IUPAC NameN,N-diethyl-1-[(2-fluorophenyl)methyl]piperidine-4-carboxamide
SMILESCCN(CC)C(=O)C1CCN(Cc2ccccc2F)CC1
InChIInChI=1S/C17H25FN2O/c1-3-20(4-2)17(21)14-9-11-19(12-10-14)13-15-7-5-6-8-16(15)18/h5-8,14H,3-4,9-13H2,1-2H3
InChIKeyGAOGKMGPFNCBTP-UHFFFAOYSA-N
XLogP2.91
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.40
LogP ≤ 52.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N,N-diethyl-1-[(2-fluorophenyl)methyl]piperidine-4-carboxamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-1-[(2-fluorophenyl)methyl]piperidine-4-carboxamide?
The IUPAC name of N,N-diethyl-1-[(2-fluorophenyl)methyl]piperidine-4-carboxamide (CID 1076485) is N,N-diethyl-1-[(2-fluorophenyl)methyl]piperidine-4-carboxamide.
What is the SMILES notation for N,N-diethyl-1-[(2-fluorophenyl)methyl]piperidine-4-carboxamide?
The canonical SMILES for N,N-diethyl-1-[(2-fluorophenyl)methyl]piperidine-4-carboxamide is CCN(CC)C(=O)C1CCN(Cc2ccccc2F)CC1.
What is the InChIKey of N,N-diethyl-1-[(2-fluorophenyl)methyl]piperidine-4-carboxamide?
The InChIKey is GAOGKMGPFNCBTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25FN2O/c1-3-20(4-2)17(21)14-9-11-19(12-10-14)13-15-7-5-6-8-16(15)18/h5-8,14H,3-4,9-13H2,1-2H3.
What are the key properties of N,N-diethyl-1-[(2-fluorophenyl)methyl]piperidine-4-carboxamide?
N,N-diethyl-1-[(2-fluorophenyl)methyl]piperidine-4-carboxamide has a molecular weight of 292.40 g/mol, XLogP of 2.91, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-1-[(2-fluorophenyl)methyl]piperidine-4-carboxamide is sourced from PubChem (CID 1076485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).