1-(4-ethylphenyl)-2-methyl-5-phenylpiperazine

C19H24N2 — CID 64931217

IUPAC1-(4-ethylphenyl)-2-methyl-5-phenylpiperazine
SMILESCCc1ccc(N2CC(c3ccccc3)NCC2C)cc1
InChIInChI=1S/C19H24N2/c1-3-16-9-11-18(12-10-16)21-14-19(20-13-15(21)2)17-7-5-4-6-8-17/h4-12,15,19-20H,3,13-14H2,1-2H3
InChIKeyFVXMIEPKIJFKSJ-UHFFFAOYSA-N
MW280.42 g/mol
LogP3.79
Rot. Bonds3

About 1-(4-ethylphenyl)-2-methyl-5-phenylpiperazine

1-(4-ethylphenyl)-2-methyl-5-phenylpiperazine (PubChem CID 64931217) has the molecular formula C19H24N2 and a molecular weight of 280.42 g/mol. Its IUPAC name is 1-(4-ethylphenyl)-2-methyl-5-phenylpiperazine.

Molecular Properties

Compound Name1-(4-ethylphenyl)-2-methyl-5-phenylpiperazine
PubChem CID64931217
Molecular FormulaC19H24N2
Molecular Weight280.42 g/mol
Exact Mass280.19
IUPAC Name1-(4-ethylphenyl)-2-methyl-5-phenylpiperazine
SMILESCCc1ccc(N2CC(c3ccccc3)NCC2C)cc1
InChIInChI=1S/C19H24N2/c1-3-16-9-11-18(12-10-16)21-14-19(20-13-15(21)2)17-7-5-4-6-8-17/h4-12,15,19-20H,3,13-14H2,1-2H3
InChIKeyFVXMIEPKIJFKSJ-UHFFFAOYSA-N
XLogP3.79
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.42
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

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Related Compounds

1-(3,4-dichlorophenyl)-2-methyl-5-phenylpiperazine
CID 64935055
5-(2-methyl-5-phenylpiperazin-1-yl)pyrimidine
CID 107590217
(2S,5S)-1,2-dimethyl-5-phenylpiperazine
CID 96624962
1-(4-fluoro-2-iodophenyl)-2-methyl-5-phenylpiperazine
CID 79760884
2-methyl-1-(2-methylpentyl)-5-phenylpiperazine
CID 64875917
(2R,5S)-1-cyclopropyl-2-methyl-5-phenylpiperazine
CID 169115914
1-(2-fluoroethyl)-2-methyl-5-phenylpiperazine
CID 80696742
2-methyl-5-phenyl-1-(2-propylsulfonylethyl)piperazine
CID 106733197
1-(4-bromo-2-chlorophenyl)-2-methyl-5-phenylpiperazine
CID 64934541
2-methyl-1-(3-methyl-2-propan-2-ylbutyl)-5-phenylpiperazine
CID 102908543
1-(4-ethylcyclohexyl)-2-methyl-5-phenylpiperazine
CID 64947768
1-(2-ethoxyethyl)-2-methyl-5-phenylpiperazine
CID 64877643

Frequently Asked Questions

What is the IUPAC name of 1-(4-ethylphenyl)-2-methyl-5-phenylpiperazine?
The IUPAC name of 1-(4-ethylphenyl)-2-methyl-5-phenylpiperazine (CID 64931217) is 1-(4-ethylphenyl)-2-methyl-5-phenylpiperazine.
What is the SMILES notation for 1-(4-ethylphenyl)-2-methyl-5-phenylpiperazine?
The canonical SMILES for 1-(4-ethylphenyl)-2-methyl-5-phenylpiperazine is CCc1ccc(N2CC(c3ccccc3)NCC2C)cc1.
What is the InChIKey of 1-(4-ethylphenyl)-2-methyl-5-phenylpiperazine?
The InChIKey is FVXMIEPKIJFKSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2/c1-3-16-9-11-18(12-10-16)21-14-19(20-13-15(21)2)17-7-5-4-6-8-17/h4-12,15,19-20H,3,13-14H2,1-2H3.
What are the key properties of 1-(4-ethylphenyl)-2-methyl-5-phenylpiperazine?
1-(4-ethylphenyl)-2-methyl-5-phenylpiperazine has a molecular weight of 280.42 g/mol, XLogP of 3.79, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethylphenyl)-2-methyl-5-phenylpiperazine is sourced from PubChem (CID 64931217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).