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

C15H20FN3O2 — CID 119299543

IUPACN-[2-[(4-fluorobenzoyl)amino]ethyl]piperidine-2-carboxamide
SMILESO=C(NCCNC(=O)C1CCCCN1)c1ccc(F)cc1
InChIInChI=1S/C15H20FN3O2/c16-12-6-4-11(5-7-12)14(20)18-9-10-19-15(21)13-3-1-2-8-17-13/h4-7,13,17H,1-3,8-10H2,(H,18,20)(H,19,21)
InChIKeyVQHRWWIUJVCDNE-UHFFFAOYSA-N
MW293.34 g/mol
LogP0.81
Rot. Bonds5

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

N-[2-[(4-fluorobenzoyl)amino]ethyl]piperidine-2-carboxamide (PubChem CID 119299543) 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-2-carboxamide.

Molecular Properties

Compound NameN-[2-[(4-fluorobenzoyl)amino]ethyl]piperidine-2-carboxamide
PubChem CID119299543
Molecular FormulaC15H20FN3O2
Molecular Weight293.34 g/mol
Exact Mass293.15
IUPAC NameN-[2-[(4-fluorobenzoyl)amino]ethyl]piperidine-2-carboxamide
SMILESO=C(NCCNC(=O)C1CCCCN1)c1ccc(F)cc1
InChIInChI=1S/C15H20FN3O2/c16-12-6-4-11(5-7-12)14(20)18-9-10-19-15(21)13-3-1-2-8-17-13/h4-7,13,17H,1-3,8-10H2,(H,18,20)(H,19,21)
InChIKeyVQHRWWIUJVCDNE-UHFFFAOYSA-N
XLogP0.81
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 ≤ 50.81
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-fluorobenzoyl)amino]ethyl]pyrrolidine-2-carboxamide;hydrochloride
CID 119299555
N-[2-[(4-bromobenzoyl)amino]ethyl]pyrrolidine-2-carboxamide
CID 119299525
N-[(4-fluorophenyl)methyl]piperidine-2-carboxamide
CID 11615609
(2S)-N-[2-(4-fluorophenyl)ethyl]pyrrolidine-2-carboxamide;hydrochloride
CID 119263955
N-[2-[(4-fluorobenzoyl)amino]ethyl]piperidine-4-carboxamide
CID 46103850
4-[2-[[(2S)-piperidine-2-carbonyl]amino]ethyl]benzoic acid
CID 103869402
N-[(2,5-difluorophenyl)methyl]piperidine-2-carboxamide
CID 63795889
N-[4-[(2-fluorophenyl)methylcarbamoyl]phenyl]piperidine-2-carboxamide;hydrochloride
CID 119286603
N-[2-[(4-fluorobenzoyl)amino]ethyl]piperidine-3-carboxamide;hydrochloride
CID 119299562
(3R)-N-[2-[(4-fluorobenzoyl)amino]ethyl]-2,8-diazaspiro[4.5]decane-3-carboxamide
CID 95724857
(2R)-N-[4-(2-pyrrolidin-1-ylethylcarbamoyl)phenyl]piperidine-2-carboxamide
CID 119885587
N-[[1-(4-fluorophenyl)cyclobutyl]methyl]piperidine-2-carboxamide
CID 119310485

Frequently Asked Questions

What is the IUPAC name of N-[2-[(4-fluorobenzoyl)amino]ethyl]piperidine-2-carboxamide?
The IUPAC name of N-[2-[(4-fluorobenzoyl)amino]ethyl]piperidine-2-carboxamide (CID 119299543) is N-[2-[(4-fluorobenzoyl)amino]ethyl]piperidine-2-carboxamide.
What is the SMILES notation for N-[2-[(4-fluorobenzoyl)amino]ethyl]piperidine-2-carboxamide?
The canonical SMILES for N-[2-[(4-fluorobenzoyl)amino]ethyl]piperidine-2-carboxamide is O=C(NCCNC(=O)C1CCCCN1)c1ccc(F)cc1.
What is the InChIKey of N-[2-[(4-fluorobenzoyl)amino]ethyl]piperidine-2-carboxamide?
The InChIKey is VQHRWWIUJVCDNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20FN3O2/c16-12-6-4-11(5-7-12)14(20)18-9-10-19-15(21)13-3-1-2-8-17-13/h4-7,13,17H,1-3,8-10H2,(H,18,20)(H,19,21).
What are the key properties of N-[2-[(4-fluorobenzoyl)amino]ethyl]piperidine-2-carboxamide?
N-[2-[(4-fluorobenzoyl)amino]ethyl]piperidine-2-carboxamide has a molecular weight of 293.34 g/mol, XLogP of 0.81, 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-2-carboxamide is sourced from PubChem (CID 119299543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).