N-(3-fluorophenyl)-1-(furan-2-carbonyl)piperidine-4-carboxamide

C17H17FN2O3 — CID 6462369

IUPACN-(3-fluorophenyl)-1-(furan-2-carbonyl)piperidine-4-carboxamide
SMILESO=C(Nc1cccc(F)c1)C1CCN(C(=O)c2ccco2)CC1
InChIInChI=1S/C17H17FN2O3/c18-13-3-1-4-14(11-13)19-16(21)12-6-8-20(9-7-12)17(22)15-5-2-10-23-15/h1-5,10-12H,6-9H2,(H,19,21)
InChIKeyFOVKSYJGIQNDMJ-UHFFFAOYSA-N
MW316.33 g/mol
LogP2.91
Rot. Bonds3

About N-(3-fluorophenyl)-1-(furan-2-carbonyl)piperidine-4-carboxamide

N-(3-fluorophenyl)-1-(furan-2-carbonyl)piperidine-4-carboxamide (PubChem CID 6462369) has the molecular formula C17H17FN2O3 and a molecular weight of 316.33 g/mol. Its IUPAC name is N-(3-fluorophenyl)-1-(furan-2-carbonyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-(3-fluorophenyl)-1-(furan-2-carbonyl)piperidine-4-carboxamide
PubChem CID6462369
Molecular FormulaC17H17FN2O3
Molecular Weight316.33 g/mol
Exact Mass316.12
IUPAC NameN-(3-fluorophenyl)-1-(furan-2-carbonyl)piperidine-4-carboxamide
SMILESO=C(Nc1cccc(F)c1)C1CCN(C(=O)c2ccco2)CC1
InChIInChI=1S/C17H17FN2O3/c18-13-3-1-4-14(11-13)19-16(21)12-6-8-20(9-7-12)17(22)15-5-2-10-23-15/h1-5,10-12H,6-9H2,(H,19,21)
InChIKeyFOVKSYJGIQNDMJ-UHFFFAOYSA-N
XLogP2.91
TPSA62.55 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.33
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(3-fluorophenyl)-1-(furan-2-carbonyl)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-(3-fluorophenyl)-1-(furan-2-carbonyl)piperidine-4-carboxamide?
The IUPAC name of N-(3-fluorophenyl)-1-(furan-2-carbonyl)piperidine-4-carboxamide (CID 6462369) is N-(3-fluorophenyl)-1-(furan-2-carbonyl)piperidine-4-carboxamide.
What is the SMILES notation for N-(3-fluorophenyl)-1-(furan-2-carbonyl)piperidine-4-carboxamide?
The canonical SMILES for N-(3-fluorophenyl)-1-(furan-2-carbonyl)piperidine-4-carboxamide is O=C(Nc1cccc(F)c1)C1CCN(C(=O)c2ccco2)CC1.
What is the InChIKey of N-(3-fluorophenyl)-1-(furan-2-carbonyl)piperidine-4-carboxamide?
The InChIKey is FOVKSYJGIQNDMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17FN2O3/c18-13-3-1-4-14(11-13)19-16(21)12-6-8-20(9-7-12)17(22)15-5-2-10-23-15/h1-5,10-12H,6-9H2,(H,19,21).
What are the key properties of N-(3-fluorophenyl)-1-(furan-2-carbonyl)piperidine-4-carboxamide?
N-(3-fluorophenyl)-1-(furan-2-carbonyl)piperidine-4-carboxamide has a molecular weight of 316.33 g/mol, XLogP of 2.91, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluorophenyl)-1-(furan-2-carbonyl)piperidine-4-carboxamide is sourced from PubChem (CID 6462369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).