5-ethyl-1-(4-methylpentyl)-2-phenylpiperazine

C18H30N2 — CID 64940985

IUPAC5-ethyl-1-(4-methylpentyl)-2-phenylpiperazine
SMILESCCC1CN(CCCC(C)C)C(c2ccccc2)CN1
InChIInChI=1S/C18H30N2/c1-4-17-14-20(12-8-9-15(2)3)18(13-19-17)16-10-6-5-7-11-16/h5-7,10-11,15,17-19H,4,8-9,12-14H2,1-3H3
InChIKeyCUWILGZECXYZBM-UHFFFAOYSA-N
MW274.45 g/mol
LogP3.85
Rot. Bonds6

About 5-ethyl-1-(4-methylpentyl)-2-phenylpiperazine

5-ethyl-1-(4-methylpentyl)-2-phenylpiperazine (PubChem CID 64940985) has the molecular formula C18H30N2 and a molecular weight of 274.45 g/mol. Its IUPAC name is 5-ethyl-1-(4-methylpentyl)-2-phenylpiperazine.

Molecular Properties

Compound Name5-ethyl-1-(4-methylpentyl)-2-phenylpiperazine
PubChem CID64940985
Molecular FormulaC18H30N2
Molecular Weight274.45 g/mol
Exact Mass274.24
IUPAC Name5-ethyl-1-(4-methylpentyl)-2-phenylpiperazine
SMILESCCC1CN(CCCC(C)C)C(c2ccccc2)CN1
InChIInChI=1S/C18H30N2/c1-4-17-14-20(12-8-9-15(2)3)18(13-19-17)16-10-6-5-7-11-16/h5-7,10-11,15,17-19H,4,8-9,12-14H2,1-3H3
InChIKeyCUWILGZECXYZBM-UHFFFAOYSA-N
XLogP3.85
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.45
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-ethyl-1-hex-5-ynyl-2-phenylpiperazine
CID 106211749
1-benzyl-5-ethyl-2-phenylpiperazine
CID 64841572
5-ethyl-2-phenyl-1-propan-2-ylpiperazine
CID 64843317
1-(cyclobutylmethyl)-5-ethyl-2-phenylpiperazine
CID 64935193
5-butan-2-yl-1-(3-methylbutyl)-2-phenylpiperazine
CID 64849021
2-ethyl-1-(4-methylpentyl)-5-phenylpiperazine
CID 64939440
N,N-dimethyl-3-(2-phenyl-5-propylpiperazin-1-yl)propan-1-amine
CID 64934814
5-ethyl-2-phenyl-1-(pyridin-4-ylmethyl)piperazine
CID 64841963
1-(cyclopropylmethyl)-5-(2-methylpropyl)-2-phenylpiperazine
CID 64847979
5-benzyl-2-methyl-1-(4-methylpentyl)piperazine
CID 64937615
1-(7-methyloctyl)-2-phenylpiperazine
CID 107818420
5-methyl-1-octyl-2-phenylpiperazine
CID 64845541

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-1-(4-methylpentyl)-2-phenylpiperazine?
The IUPAC name of 5-ethyl-1-(4-methylpentyl)-2-phenylpiperazine (CID 64940985) is 5-ethyl-1-(4-methylpentyl)-2-phenylpiperazine.
What is the SMILES notation for 5-ethyl-1-(4-methylpentyl)-2-phenylpiperazine?
The canonical SMILES for 5-ethyl-1-(4-methylpentyl)-2-phenylpiperazine is CCC1CN(CCCC(C)C)C(c2ccccc2)CN1.
What is the InChIKey of 5-ethyl-1-(4-methylpentyl)-2-phenylpiperazine?
The InChIKey is CUWILGZECXYZBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N2/c1-4-17-14-20(12-8-9-15(2)3)18(13-19-17)16-10-6-5-7-11-16/h5-7,10-11,15,17-19H,4,8-9,12-14H2,1-3H3.
What are the key properties of 5-ethyl-1-(4-methylpentyl)-2-phenylpiperazine?
5-ethyl-1-(4-methylpentyl)-2-phenylpiperazine has a molecular weight of 274.45 g/mol, XLogP of 3.85, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-1-(4-methylpentyl)-2-phenylpiperazine is sourced from PubChem (CID 64940985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).