1-[(4-ethylphenyl)-phenylmethyl]piperazine

C19H24N2 — CID 3530514

IUPAC1-[(4-ethylphenyl)-phenylmethyl]piperazine
SMILESCCc1ccc(C(c2ccccc2)N2CCNCC2)cc1
InChIInChI=1S/C19H24N2/c1-2-16-8-10-18(11-9-16)19(17-6-4-3-5-7-17)21-14-12-20-13-15-21/h3-11,19-20H,2,12-15H2,1H3
InChIKeyIBCCHIOQTUNLJI-UHFFFAOYSA-N
MW280.42 g/mol
LogP3.24
Rot. Bonds4

About 1-[(4-ethylphenyl)-phenylmethyl]piperazine

1-[(4-ethylphenyl)-phenylmethyl]piperazine (PubChem CID 3530514) has the molecular formula C19H24N2 and a molecular weight of 280.42 g/mol. Its IUPAC name is 1-[(4-ethylphenyl)-phenylmethyl]piperazine.

Molecular Properties

Compound Name1-[(4-ethylphenyl)-phenylmethyl]piperazine
PubChem CID3530514
Molecular FormulaC19H24N2
Molecular Weight280.42 g/mol
Exact Mass280.19
IUPAC Name1-[(4-ethylphenyl)-phenylmethyl]piperazine
SMILESCCc1ccc(C(c2ccccc2)N2CCNCC2)cc1
InChIInChI=1S/C19H24N2/c1-2-16-8-10-18(11-9-16)19(17-6-4-3-5-7-17)21-14-12-20-13-15-21/h3-11,19-20H,2,12-15H2,1H3
InChIKeyIBCCHIOQTUNLJI-UHFFFAOYSA-N
XLogP3.24
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.42
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-[(4-ethylphenyl)-piperazin-1-ylmethyl]-N,N-dimethylaniline
CID 3902289
2-[(4-ethylphenyl)-piperazin-1-ylmethyl]-1,3-benzothiazole
CID 3458423
1-[(S)-(4-methoxyphenyl)-phenylmethyl]piperazine
CID 7047760
1-[(4-benzylphenyl)-(4-chlorophenyl)methyl]piperazine
CID 4738631
1-[(R)-(4-chlorophenyl)-phenylmethyl]piperazine;dihydrochloride
CID 24745687
1-[(5-chlorothiophen-2-yl)-(4-ethylphenyl)methyl]piperazine
CID 4015812
1-[(S)-(3-methylphenyl)-phenylmethyl]piperazine
CID 92754605
1-[phenyl(pyridin-4-yl)methyl]piperazine
CID 5035634
1-[(1R)-1-(4-ethylphenyl)-2,2-difluoroethyl]piperazine
CID 171281145
1-[4-[phenyl(piperazin-1-yl)methyl]phenyl]ethanone;dihydrochloride
CID 23447945
1-[(4-methoxyphenyl)-phenylmethyl]-1,4-diazepane
CID 3838263
1-[(3-ethoxy-4-methoxyphenyl)-phenylmethyl]piperazine
CID 3967405

Frequently Asked Questions

What is the IUPAC name of 1-[(4-ethylphenyl)-phenylmethyl]piperazine?
The IUPAC name of 1-[(4-ethylphenyl)-phenylmethyl]piperazine (CID 3530514) is 1-[(4-ethylphenyl)-phenylmethyl]piperazine.
What is the SMILES notation for 1-[(4-ethylphenyl)-phenylmethyl]piperazine?
The canonical SMILES for 1-[(4-ethylphenyl)-phenylmethyl]piperazine is CCc1ccc(C(c2ccccc2)N2CCNCC2)cc1.
What is the InChIKey of 1-[(4-ethylphenyl)-phenylmethyl]piperazine?
The InChIKey is IBCCHIOQTUNLJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2/c1-2-16-8-10-18(11-9-16)19(17-6-4-3-5-7-17)21-14-12-20-13-15-21/h3-11,19-20H,2,12-15H2,1H3.
What are the key properties of 1-[(4-ethylphenyl)-phenylmethyl]piperazine?
1-[(4-ethylphenyl)-phenylmethyl]piperazine has a molecular weight of 280.42 g/mol, XLogP of 3.24, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-ethylphenyl)-phenylmethyl]piperazine is sourced from PubChem (CID 3530514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).