1-(2-methylphenyl)-4-[(2-phenylphenyl)methyl]piperazine

C24H26N2 — CID 71602587

IUPAC1-(2-methylphenyl)-4-[(2-phenylphenyl)methyl]piperazine
SMILESCc1ccccc1N1CCN(Cc2ccccc2-c2ccccc2)CC1
InChIInChI=1S/C24H26N2/c1-20-9-5-8-14-24(20)26-17-15-25(16-18-26)19-22-12-6-7-13-23(22)21-10-3-2-4-11-21/h2-14H,15-19H2,1H3
InChIKeyGCBOCWXJTQDYBL-UHFFFAOYSA-N
MW342.49 g/mol
LogP4.98
Rot. Bonds4

About 1-(2-methylphenyl)-4-[(2-phenylphenyl)methyl]piperazine

1-(2-methylphenyl)-4-[(2-phenylphenyl)methyl]piperazine (PubChem CID 71602587) has the molecular formula C24H26N2 and a molecular weight of 342.49 g/mol. Its IUPAC name is 1-(2-methylphenyl)-4-[(2-phenylphenyl)methyl]piperazine.

Molecular Properties

Compound Name1-(2-methylphenyl)-4-[(2-phenylphenyl)methyl]piperazine
PubChem CID71602587
Molecular FormulaC24H26N2
Molecular Weight342.49 g/mol
Exact Mass342.21
IUPAC Name1-(2-methylphenyl)-4-[(2-phenylphenyl)methyl]piperazine
SMILESCc1ccccc1N1CCN(Cc2ccccc2-c2ccccc2)CC1
InChIInChI=1S/C24H26N2/c1-20-9-5-8-14-24(20)26-17-15-25(16-18-26)19-22-12-6-7-13-23(22)21-10-3-2-4-11-21/h2-14H,15-19H2,1H3
InChIKeyGCBOCWXJTQDYBL-UHFFFAOYSA-N
XLogP4.98
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.49
LogP ≤ 54.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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Mianserin
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Leucomalachite green
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Bamipine
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Leucocrystal Violet
CID 69048
Mianserin Hydrochloride
CID 68551
Dimetacrine
CID 94280
Quinupramine
CID 93154
Depramine
CID 67534
Dibenzo(c,f)pyrazino(1,2-a)azepine, 1,2,3,4,10,14b-hexahydro-2-methyl-, (14bS)-
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1-(1-Naphthyl)piperazine
CID 1342
Phenbenzamine
CID 13751

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylphenyl)-4-[(2-phenylphenyl)methyl]piperazine?
The IUPAC name of 1-(2-methylphenyl)-4-[(2-phenylphenyl)methyl]piperazine (CID 71602587) is 1-(2-methylphenyl)-4-[(2-phenylphenyl)methyl]piperazine.
What is the SMILES notation for 1-(2-methylphenyl)-4-[(2-phenylphenyl)methyl]piperazine?
The canonical SMILES for 1-(2-methylphenyl)-4-[(2-phenylphenyl)methyl]piperazine is Cc1ccccc1N1CCN(Cc2ccccc2-c2ccccc2)CC1.
What is the InChIKey of 1-(2-methylphenyl)-4-[(2-phenylphenyl)methyl]piperazine?
The InChIKey is GCBOCWXJTQDYBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N2/c1-20-9-5-8-14-24(20)26-17-15-25(16-18-26)19-22-12-6-7-13-23(22)21-10-3-2-4-11-21/h2-14H,15-19H2,1H3.
What are the key properties of 1-(2-methylphenyl)-4-[(2-phenylphenyl)methyl]piperazine?
1-(2-methylphenyl)-4-[(2-phenylphenyl)methyl]piperazine has a molecular weight of 342.49 g/mol, XLogP of 4.98, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylphenyl)-4-[(2-phenylphenyl)methyl]piperazine is sourced from PubChem (CID 71602587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).