N-(4-fluorophenyl)piperazine-2-carboxamide

C11H14FN3O — CID 63103447

IUPACN-(4-fluorophenyl)piperazine-2-carboxamide
SMILESO=C(Nc1ccc(F)cc1)C1CNCCN1
InChIInChI=1S/C11H14FN3O/c12-8-1-3-9(4-2-8)15-11(16)10-7-13-5-6-14-10/h1-4,10,13-14H,5-7H2,(H,15,16)
InChIKeyCXPCRYAFKSPYQC-UHFFFAOYSA-N
MW223.25 g/mol
LogP0.33
Rot. Bonds2

About N-(4-fluorophenyl)piperazine-2-carboxamide

N-(4-fluorophenyl)piperazine-2-carboxamide (PubChem CID 63103447) has the molecular formula C11H14FN3O and a molecular weight of 223.25 g/mol. Its IUPAC name is N-(4-fluorophenyl)piperazine-2-carboxamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)piperazine-2-carboxamide
PubChem CID63103447
Molecular FormulaC11H14FN3O
Molecular Weight223.25 g/mol
Exact Mass223.11
IUPAC NameN-(4-fluorophenyl)piperazine-2-carboxamide
SMILESO=C(Nc1ccc(F)cc1)C1CNCCN1
InChIInChI=1S/C11H14FN3O/c12-8-1-3-9(4-2-8)15-11(16)10-7-13-5-6-14-10/h1-4,10,13-14H,5-7H2,(H,15,16)
InChIKeyCXPCRYAFKSPYQC-UHFFFAOYSA-N
XLogP0.33
TPSA53.16 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.25
LogP ≤ 50.33
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-acetamidophenyl)piperazine-2-carboxamide
CID 63103626
N-(3-fluorophenyl)piperazine-2-carboxamide
CID 63103446
N-(4-fluorophenyl)pyrazolidine-3-carboxamide
CID 75220517
N-(3-sulfamoylphenyl)piperazine-2-carboxamide
CID 55177452
(2R)-4-acetyl-N-(4-fluorophenyl)piperazine-2-carboxamide
CID 124987342
4-acetyl-N-(4-fluorophenyl)piperazine-2-carboxamide
CID 110086720
N-(4-fluorophenyl)cyclopropanecarboxamide
CID 532027
N-(2,4-dimethylphenyl)piperazine-2-carboxamide
CID 55178030
(2R)-N-(4-iodophenyl)pyrrolidine-2-carboxamide
CID 28881297
N-(4-fluorophenyl)-4-(5-fluoropyrimidin-2-yl)piperazine-2-carboxamide
CID 56904879
(4S)-N-(4-fluorophenyl)-2-oxo-1,3-oxazolidine-4-carboxamide
CID 175520739
N-(4-fluorophenyl)-2-oxo-1,3-oxazolidine-4-carboxamide
CID 110649976

Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)piperazine-2-carboxamide?
The IUPAC name of N-(4-fluorophenyl)piperazine-2-carboxamide (CID 63103447) is N-(4-fluorophenyl)piperazine-2-carboxamide.
What is the SMILES notation for N-(4-fluorophenyl)piperazine-2-carboxamide?
The canonical SMILES for N-(4-fluorophenyl)piperazine-2-carboxamide is O=C(Nc1ccc(F)cc1)C1CNCCN1.
What is the InChIKey of N-(4-fluorophenyl)piperazine-2-carboxamide?
The InChIKey is CXPCRYAFKSPYQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14FN3O/c12-8-1-3-9(4-2-8)15-11(16)10-7-13-5-6-14-10/h1-4,10,13-14H,5-7H2,(H,15,16).
What are the key properties of N-(4-fluorophenyl)piperazine-2-carboxamide?
N-(4-fluorophenyl)piperazine-2-carboxamide has a molecular weight of 223.25 g/mol, XLogP of 0.33, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)piperazine-2-carboxamide is sourced from PubChem (CID 63103447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).