N-[2-(4-benzoylpiperazine-1-carbonyl)phenyl]benzamide

C25H23N3O3 — CID 32904614

IUPACN-[2-(4-benzoylpiperazine-1-carbonyl)phenyl]benzamide
SMILESO=C(Nc1ccccc1C(=O)N1CCN(C(=O)c2ccccc2)CC1)c1ccccc1
InChIInChI=1S/C25H23N3O3/c29-23(19-9-3-1-4-10-19)26-22-14-8-7-13-21(22)25(31)28-17-15-27(16-18-28)24(30)20-11-5-2-6-12-20/h1-14H,15-18H2,(H,26,29)
InChIKeyBDEPRCHEJZBACZ-UHFFFAOYSA-N
MW413.48 g/mol
LogP3.54
Rot. Bonds4

About N-[2-(4-benzoylpiperazine-1-carbonyl)phenyl]benzamide

N-[2-(4-benzoylpiperazine-1-carbonyl)phenyl]benzamide (PubChem CID 32904614) has the molecular formula C25H23N3O3 and a molecular weight of 413.48 g/mol. Its IUPAC name is N-[2-(4-benzoylpiperazine-1-carbonyl)phenyl]benzamide.

Molecular Properties

Compound NameN-[2-(4-benzoylpiperazine-1-carbonyl)phenyl]benzamide
PubChem CID32904614
Molecular FormulaC25H23N3O3
Molecular Weight413.48 g/mol
Exact Mass413.17
IUPAC NameN-[2-(4-benzoylpiperazine-1-carbonyl)phenyl]benzamide
SMILESO=C(Nc1ccccc1C(=O)N1CCN(C(=O)c2ccccc2)CC1)c1ccccc1
InChIInChI=1S/C25H23N3O3/c29-23(19-9-3-1-4-10-19)26-22-14-8-7-13-21(22)25(31)28-17-15-27(16-18-28)24(30)20-11-5-2-6-12-20/h1-14H,15-18H2,(H,26,29)
InChIKeyBDEPRCHEJZBACZ-UHFFFAOYSA-N
XLogP3.54
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500413.48
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-N,4-N-bis[2-(azepane-1-carbonyl)phenyl]benzene-1,4-dicarboxamide
CID 4938376
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CID 4930482
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N-[2-[4-(methylaminomethyl)piperidine-1-carbonyl]phenyl]benzamide;hydrochloride
CID 119545134
4-piperidin-1-yl-N-[2-(pyrrolidine-1-carbonyl)phenyl]benzamide
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N-[2-(2,6-dimethylmorpholine-4-carbonyl)phenyl]benzamide
CID 42888700
N-[2-[4-(3,4-difluorophenyl)sulfonylpiperazine-1-carbonyl]phenyl]benzamide
CID 32644263
N-[2-(4-methylpiperazine-1-carbonyl)phenyl]thiophene-3-carboxamide
CID 39652535
3-methyl-N-[2-(4-phenylpiperazine-1-carbonyl)phenyl]benzamide;hydrochloride
CID 171151506
N-[2-(morpholine-4-carbonyl)phenyl]-4-phenoxybenzamide
CID 35325582

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-benzoylpiperazine-1-carbonyl)phenyl]benzamide?
The IUPAC name of N-[2-(4-benzoylpiperazine-1-carbonyl)phenyl]benzamide (CID 32904614) is N-[2-(4-benzoylpiperazine-1-carbonyl)phenyl]benzamide.
What is the SMILES notation for N-[2-(4-benzoylpiperazine-1-carbonyl)phenyl]benzamide?
The canonical SMILES for N-[2-(4-benzoylpiperazine-1-carbonyl)phenyl]benzamide is O=C(Nc1ccccc1C(=O)N1CCN(C(=O)c2ccccc2)CC1)c1ccccc1.
What is the InChIKey of N-[2-(4-benzoylpiperazine-1-carbonyl)phenyl]benzamide?
The InChIKey is BDEPRCHEJZBACZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H23N3O3/c29-23(19-9-3-1-4-10-19)26-22-14-8-7-13-21(22)25(31)28-17-15-27(16-18-28)24(30)20-11-5-2-6-12-20/h1-14H,15-18H2,(H,26,29).
What are the key properties of N-[2-(4-benzoylpiperazine-1-carbonyl)phenyl]benzamide?
N-[2-(4-benzoylpiperazine-1-carbonyl)phenyl]benzamide has a molecular weight of 413.48 g/mol, XLogP of 3.54, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-benzoylpiperazine-1-carbonyl)phenyl]benzamide is sourced from PubChem (CID 32904614), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).