N-[2-[(4-fluorobenzoyl)amino]ethyl]piperidine-4-carboxamide

C15H20FN3O2 — CID 46103850

IUPACN-[2-[(4-fluorobenzoyl)amino]ethyl]piperidine-4-carboxamide
SMILESO=C(NCCNC(=O)C1CCNCC1)c1ccc(F)cc1
InChIInChI=1S/C15H20FN3O2/c16-13-3-1-11(2-4-13)14(20)18-9-10-19-15(21)12-5-7-17-8-6-12/h1-4,12,17H,5-10H2,(H,18,20)(H,19,21)
InChIKeyLVYBNNHNEJXFOO-UHFFFAOYSA-N
MW293.34 g/mol
LogP0.67
Rot. Bonds5

About N-[2-[(4-fluorobenzoyl)amino]ethyl]piperidine-4-carboxamide

N-[2-[(4-fluorobenzoyl)amino]ethyl]piperidine-4-carboxamide (PubChem CID 46103850) has the molecular formula C15H20FN3O2 and a molecular weight of 293.34 g/mol. Its IUPAC name is N-[2-[(4-fluorobenzoyl)amino]ethyl]piperidine-4-carboxamide.

Molecular Properties

Compound NameN-[2-[(4-fluorobenzoyl)amino]ethyl]piperidine-4-carboxamide
PubChem CID46103850
Molecular FormulaC15H20FN3O2
Molecular Weight293.34 g/mol
Exact Mass293.15
IUPAC NameN-[2-[(4-fluorobenzoyl)amino]ethyl]piperidine-4-carboxamide
SMILESO=C(NCCNC(=O)C1CCNCC1)c1ccc(F)cc1
InChIInChI=1S/C15H20FN3O2/c16-13-3-1-11(2-4-13)14(20)18-9-10-19-15(21)12-5-7-17-8-6-12/h1-4,12,17H,5-10H2,(H,18,20)(H,19,21)
InChIKeyLVYBNNHNEJXFOO-UHFFFAOYSA-N
XLogP0.67
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.34
LogP ≤ 50.67
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[2-[(4-chlorobenzoyl)amino]ethyl]piperidine-4-carboxamide;hydrochloride
CID 119278612
N-[2-[(4-methylbenzoyl)amino]ethyl]piperidine-4-carboxamide;hydrochloride
CID 119299588
N-[2-[(4-fluorobenzoyl)amino]ethyl]piperidine-3-carboxamide;hydrochloride
CID 119299562
N-[2-(4-fluorophenyl)ethyl]piperidine-4-carboxamide
CID 16769811
N-[2-(4-fluorophenyl)ethyl]piperidine-4-carboxamide;hydrochloride
CID 119263949
N-[2-[(3-fluoro-4-methylbenzoyl)amino]ethyl]pyrrolidine-3-carboxamide
CID 119704149
4-fluoro-N-(2-piperidin-4-yloxyethyl)benzamide
CID 55251922
(2S,4S)-N-[3-[(4-fluorobenzoyl)amino]propyl]-2-methylpiperidine-4-carboxamide;hydrochloride
CID 120632447
N-[2-[(4-fluorobenzoyl)amino]ethyl]piperidine-2-carboxamide
CID 119299543
N-[2-[(4-fluorobenzoyl)amino]ethyl]pyrrolidine-2-carboxamide;hydrochloride
CID 119299555
1-butanoyl-N-[2-[(4-fluorobenzoyl)amino]ethyl]piperidine-4-carboxamide
CID 42878774
1-(3,4-dichlorobenzoyl)-N-[2-[(4-fluorobenzoyl)amino]ethyl]piperidine-4-carboxamide
CID 24717415

Frequently Asked Questions

What is the IUPAC name of N-[2-[(4-fluorobenzoyl)amino]ethyl]piperidine-4-carboxamide?
The IUPAC name of N-[2-[(4-fluorobenzoyl)amino]ethyl]piperidine-4-carboxamide (CID 46103850) is N-[2-[(4-fluorobenzoyl)amino]ethyl]piperidine-4-carboxamide.
What is the SMILES notation for N-[2-[(4-fluorobenzoyl)amino]ethyl]piperidine-4-carboxamide?
The canonical SMILES for N-[2-[(4-fluorobenzoyl)amino]ethyl]piperidine-4-carboxamide is O=C(NCCNC(=O)C1CCNCC1)c1ccc(F)cc1.
What is the InChIKey of N-[2-[(4-fluorobenzoyl)amino]ethyl]piperidine-4-carboxamide?
The InChIKey is LVYBNNHNEJXFOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20FN3O2/c16-13-3-1-11(2-4-13)14(20)18-9-10-19-15(21)12-5-7-17-8-6-12/h1-4,12,17H,5-10H2,(H,18,20)(H,19,21).
What are the key properties of N-[2-[(4-fluorobenzoyl)amino]ethyl]piperidine-4-carboxamide?
N-[2-[(4-fluorobenzoyl)amino]ethyl]piperidine-4-carboxamide has a molecular weight of 293.34 g/mol, XLogP of 0.67, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(4-fluorobenzoyl)amino]ethyl]piperidine-4-carboxamide is sourced from PubChem (CID 46103850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).