N-(4-benzoylphenyl)-4-piperazin-1-ylbenzamide

C24H23N3O2 — CID 174547037

IUPACN-(4-benzoylphenyl)-4-piperazin-1-ylbenzamide
SMILESO=C(Nc1ccc(C(=O)c2ccccc2)cc1)c1ccc(N2CCNCC2)cc1
InChIInChI=1S/C24H23N3O2/c28-23(18-4-2-1-3-5-18)19-6-10-21(11-7-19)26-24(29)20-8-12-22(13-9-20)27-16-14-25-15-17-27/h1-13,25H,14-17H2,(H,26,29)
InChIKeyHANLBKRQNIQZAN-UHFFFAOYSA-N
MW385.47 g/mol
LogP3.58
Rot. Bonds5

About N-(4-benzoylphenyl)-4-piperazin-1-ylbenzamide

N-(4-benzoylphenyl)-4-piperazin-1-ylbenzamide (PubChem CID 174547037) has the molecular formula C24H23N3O2 and a molecular weight of 385.47 g/mol. Its IUPAC name is N-(4-benzoylphenyl)-4-piperazin-1-ylbenzamide.

Molecular Properties

Compound NameN-(4-benzoylphenyl)-4-piperazin-1-ylbenzamide
PubChem CID174547037
Molecular FormulaC24H23N3O2
Molecular Weight385.47 g/mol
Exact Mass385.18
IUPAC NameN-(4-benzoylphenyl)-4-piperazin-1-ylbenzamide
SMILESO=C(Nc1ccc(C(=O)c2ccccc2)cc1)c1ccc(N2CCNCC2)cc1
InChIInChI=1S/C24H23N3O2/c28-23(18-4-2-1-3-5-18)19-6-10-21(11-7-19)26-24(29)20-8-12-22(13-9-20)27-16-14-25-15-17-27/h1-13,25H,14-17H2,(H,26,29)
InChIKeyHANLBKRQNIQZAN-UHFFFAOYSA-N
XLogP3.58
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.47
LogP ≤ 53.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-benzoyl-N-(4-piperidin-1-ylphenyl)benzamide
CID 7999170
N-[4-[4-[(4-morpholin-4-ylbenzoyl)amino]anilino]phenyl]-4-piperazin-1-ylbenzamide
CID 67112495
4-fluoro-N-[4-(4-phenylpiperazin-1-yl)phenyl]benzamide
CID 112983940
N-(3-acetylphenyl)-4-piperazin-1-ylbenzamide
CID 174533104
N-[4-(4-pyrrolidin-1-ylanilino)phenyl]benzamide
CID 112988758
N-phenyl-4-piperidin-1-ylbenzamide
CID 53282261
2-[4-[(4-piperazin-1-ylbenzoyl)amino]phenoxy]propanoic acid
CID 54057200
[4-(aziridin-1-yl)phenyl]-phenylmethanone
CID 102156745
4-benzoyl-N-(4-fluorophenyl)benzamide
CID 2315903
4-bromo-3-fluoro-N-(4-piperazin-1-ylphenyl)benzamide
CID 167838985
N-[4-(4-ethylpiperazin-1-yl)phenyl]benzamide
CID 3837739
N-[4-(1,4-diazepane-1-carbonyl)phenyl]benzamide;hydrochloride
CID 119417229

Frequently Asked Questions

What is the IUPAC name of N-(4-benzoylphenyl)-4-piperazin-1-ylbenzamide?
The IUPAC name of N-(4-benzoylphenyl)-4-piperazin-1-ylbenzamide (CID 174547037) is N-(4-benzoylphenyl)-4-piperazin-1-ylbenzamide.
What is the SMILES notation for N-(4-benzoylphenyl)-4-piperazin-1-ylbenzamide?
The canonical SMILES for N-(4-benzoylphenyl)-4-piperazin-1-ylbenzamide is O=C(Nc1ccc(C(=O)c2ccccc2)cc1)c1ccc(N2CCNCC2)cc1.
What is the InChIKey of N-(4-benzoylphenyl)-4-piperazin-1-ylbenzamide?
The InChIKey is HANLBKRQNIQZAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N3O2/c28-23(18-4-2-1-3-5-18)19-6-10-21(11-7-19)26-24(29)20-8-12-22(13-9-20)27-16-14-25-15-17-27/h1-13,25H,14-17H2,(H,26,29).
What are the key properties of N-(4-benzoylphenyl)-4-piperazin-1-ylbenzamide?
N-(4-benzoylphenyl)-4-piperazin-1-ylbenzamide has a molecular weight of 385.47 g/mol, XLogP of 3.58, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-benzoylphenyl)-4-piperazin-1-ylbenzamide is sourced from PubChem (CID 174547037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).