[4-(4-methoxyphenyl)piperazin-1-yl]-(2-phenylphenyl)methanone

C24H24N2O2 — CID 2948850

IUPAC[4-(4-methoxyphenyl)piperazin-1-yl]-(2-phenylphenyl)methanone
SMILESCOc1ccc(N2CCN(C(=O)c3ccccc3-c3ccccc3)CC2)cc1
InChIInChI=1S/C24H24N2O2/c1-28-21-13-11-20(12-14-21)25-15-17-26(18-16-25)24(27)23-10-6-5-9-22(23)19-7-3-2-4-8-19/h2-14H,15-18H2,1H3
InChIKeyQUXFYSDEPIHNCL-UHFFFAOYSA-N
MW372.47 g/mol
LogP4.32
Rot. Bonds4

About [4-(4-methoxyphenyl)piperazin-1-yl]-(2-phenylphenyl)methanone

[4-(4-methoxyphenyl)piperazin-1-yl]-(2-phenylphenyl)methanone (PubChem CID 2948850) has the molecular formula C24H24N2O2 and a molecular weight of 372.47 g/mol. Its IUPAC name is [4-(4-methoxyphenyl)piperazin-1-yl]-(2-phenylphenyl)methanone.

Molecular Properties

Compound Name[4-(4-methoxyphenyl)piperazin-1-yl]-(2-phenylphenyl)methanone
PubChem CID2948850
Molecular FormulaC24H24N2O2
Molecular Weight372.47 g/mol
Exact Mass372.18
IUPAC Name[4-(4-methoxyphenyl)piperazin-1-yl]-(2-phenylphenyl)methanone
SMILESCOc1ccc(N2CCN(C(=O)c3ccccc3-c3ccccc3)CC2)cc1
InChIInChI=1S/C24H24N2O2/c1-28-21-13-11-20(12-14-21)25-15-17-26(18-16-25)24(27)23-10-6-5-9-22(23)19-7-3-2-4-8-19/h2-14H,15-18H2,1H3
InChIKeyQUXFYSDEPIHNCL-UHFFFAOYSA-N
XLogP4.32
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.47
LogP ≤ 54.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}

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Related Compounds

[4-(4-aminophenyl)piperazin-1-yl]-(2-phenylphenyl)methanone
CID 17234149
(2-methoxyphenyl)-[4-(4-methoxyphenyl)piperazin-1-yl]methanone
CID 937879
[4-[4-(furan-2-yl)phenyl]piperazin-1-yl]-(2-phenylphenyl)methanone
CID 168527219
(2-chloro-3-pyridinyl)-[4-(4-methoxyphenyl)piperazin-1-yl]methanone
CID 9159021
[4-(4-methoxyphenyl)piperazin-1-yl]-(5-phenyl-1,3,4-oxadiazol-2-yl)methanone
CID 110390931
4-methoxy-N-[2-[4-(4-methoxyphenyl)piperazine-1-carbonyl]phenyl]benzamide
CID 55376450
[4-(3,5-dimethoxyphenyl)piperazin-1-yl]-(4-phenyl-3-pyridinyl)methanone;hydrochloride
CID 11604587
[4-(4-methoxyphenyl)piperazin-1-yl]-(2-methylsulfanyl-4-phenylpyrimidin-5-yl)methanone
CID 20913696
[4-(4-methoxyphenyl)piperazin-1-yl]-(5-phenyl-1,2-oxazol-3-yl)methanone
CID 17011323
[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]-(2-phenylphenyl)methanone
CID 37280250
(2,6-dimethoxyphenyl)-[4-(4-methoxyphenyl)piperazin-1-yl]methanone
CID 113077374
[4-(4-methoxyphenyl)piperazin-1-yl]-(2-methylsulfanyl-3-pyridinyl)methanone
CID 2091587

Frequently Asked Questions

What is the IUPAC name of [4-(4-methoxyphenyl)piperazin-1-yl]-(2-phenylphenyl)methanone?
The IUPAC name of [4-(4-methoxyphenyl)piperazin-1-yl]-(2-phenylphenyl)methanone (CID 2948850) is [4-(4-methoxyphenyl)piperazin-1-yl]-(2-phenylphenyl)methanone.
What is the SMILES notation for [4-(4-methoxyphenyl)piperazin-1-yl]-(2-phenylphenyl)methanone?
The canonical SMILES for [4-(4-methoxyphenyl)piperazin-1-yl]-(2-phenylphenyl)methanone is COc1ccc(N2CCN(C(=O)c3ccccc3-c3ccccc3)CC2)cc1.
What is the InChIKey of [4-(4-methoxyphenyl)piperazin-1-yl]-(2-phenylphenyl)methanone?
The InChIKey is QUXFYSDEPIHNCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N2O2/c1-28-21-13-11-20(12-14-21)25-15-17-26(18-16-25)24(27)23-10-6-5-9-22(23)19-7-3-2-4-8-19/h2-14H,15-18H2,1H3.
What are the key properties of [4-(4-methoxyphenyl)piperazin-1-yl]-(2-phenylphenyl)methanone?
[4-(4-methoxyphenyl)piperazin-1-yl]-(2-phenylphenyl)methanone has a molecular weight of 372.47 g/mol, XLogP of 4.32, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(4-methoxyphenyl)piperazin-1-yl]-(2-phenylphenyl)methanone is sourced from PubChem (CID 2948850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).