2,5-diethyl-N-(4-fluorophenyl)piperazine-1-carboxamide

C15H22FN3O — CID 64978294

IUPAC2,5-diethyl-N-(4-fluorophenyl)piperazine-1-carboxamide
SMILESCCC1CN(C(=O)Nc2ccc(F)cc2)C(CC)CN1
InChIInChI=1S/C15H22FN3O/c1-3-12-10-19(14(4-2)9-17-12)15(20)18-13-7-5-11(16)6-8-13/h5-8,12,14,17H,3-4,9-10H2,1-2H3,(H,18,20)
InChIKeyAZMNUFPFNIGTIX-UHFFFAOYSA-N
MW279.36 g/mol
LogP2.82
Rot. Bonds3

About 2,5-diethyl-N-(4-fluorophenyl)piperazine-1-carboxamide

2,5-diethyl-N-(4-fluorophenyl)piperazine-1-carboxamide (PubChem CID 64978294) has the molecular formula C15H22FN3O and a molecular weight of 279.36 g/mol. Its IUPAC name is 2,5-diethyl-N-(4-fluorophenyl)piperazine-1-carboxamide.

Molecular Properties

Compound Name2,5-diethyl-N-(4-fluorophenyl)piperazine-1-carboxamide
PubChem CID64978294
Molecular FormulaC15H22FN3O
Molecular Weight279.36 g/mol
Exact Mass279.17
IUPAC Name2,5-diethyl-N-(4-fluorophenyl)piperazine-1-carboxamide
SMILESCCC1CN(C(=O)Nc2ccc(F)cc2)C(CC)CN1
InChIInChI=1S/C15H22FN3O/c1-3-12-10-19(14(4-2)9-17-12)15(20)18-13-7-5-11(16)6-8-13/h5-8,12,14,17H,3-4,9-10H2,1-2H3,(H,18,20)
InChIKeyAZMNUFPFNIGTIX-UHFFFAOYSA-N
XLogP2.82
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.36
LogP ≤ 52.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2,5-diethyl-N-(4-fluorophenyl)piperazine-1-carboxamide with MolForge

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

Launch Full Analysis

Related Compounds

2,5-diethyl-N-(3-fluorophenyl)piperazine-1-carboxamide
CID 64978319
2,5-diethyl-N-(2-fluorophenyl)piperazine-1-carboxamide
CID 64978331
cyclopent-3-en-1-yl-(2,5-diethylpiperazin-1-yl)methanone
CID 64978451
cyclobutyl-(2,5-diethylpiperazin-1-yl)methanone
CID 64978279
2-(2-chloro-6-fluorophenyl)-1-(2,5-diethylpiperazin-1-yl)ethanone
CID 64978375
(2,5-diethylpiperazin-1-yl)-thiophen-3-ylmethanone
CID 64977785
(2,5-diethylpiperazin-1-yl)-(2-hydroxy-3-methoxyphenyl)methanone
CID 64977938
(5-bromothiophen-2-yl)-(2,5-diethylpiperazin-1-yl)methanone
CID 64978281
(2,5-diethylpiperazin-1-yl)-(6-methyl-3-pyridinyl)methanone
CID 64978507
(5-bromo-2-hydroxyphenyl)-(2,5-diethylpiperazin-1-yl)methanone
CID 107729955
(2R)-N-(4-fluorophenyl)-2-methylpyrrolidine-1-carboxamide
CID 90883663
2-(2-ethylpiperidin-1-yl)-N-(4-fluorophenyl)-2-oxoacetamide
CID 47336169

Frequently Asked Questions

What is the IUPAC name of 2,5-diethyl-N-(4-fluorophenyl)piperazine-1-carboxamide?
The IUPAC name of 2,5-diethyl-N-(4-fluorophenyl)piperazine-1-carboxamide (CID 64978294) is 2,5-diethyl-N-(4-fluorophenyl)piperazine-1-carboxamide.
What is the SMILES notation for 2,5-diethyl-N-(4-fluorophenyl)piperazine-1-carboxamide?
The canonical SMILES for 2,5-diethyl-N-(4-fluorophenyl)piperazine-1-carboxamide is CCC1CN(C(=O)Nc2ccc(F)cc2)C(CC)CN1.
What is the InChIKey of 2,5-diethyl-N-(4-fluorophenyl)piperazine-1-carboxamide?
The InChIKey is AZMNUFPFNIGTIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22FN3O/c1-3-12-10-19(14(4-2)9-17-12)15(20)18-13-7-5-11(16)6-8-13/h5-8,12,14,17H,3-4,9-10H2,1-2H3,(H,18,20).
What are the key properties of 2,5-diethyl-N-(4-fluorophenyl)piperazine-1-carboxamide?
2,5-diethyl-N-(4-fluorophenyl)piperazine-1-carboxamide has a molecular weight of 279.36 g/mol, XLogP of 2.82, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-diethyl-N-(4-fluorophenyl)piperazine-1-carboxamide is sourced from PubChem (CID 64978294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).