1-(3-methyl-2-phenylpentyl)piperazine

C16H26N2 — CID 62488695

IUPAC1-(3-methyl-2-phenylpentyl)piperazine
SMILESCCC(C)C(CN1CCNCC1)c1ccccc1
InChIInChI=1S/C16H26N2/c1-3-14(2)16(15-7-5-4-6-8-15)13-18-11-9-17-10-12-18/h4-8,14,16-17H,3,9-13H2,1-2H3
InChIKeyGAQKGWMGCAUZHP-UHFFFAOYSA-N
MW246.40 g/mol
LogP2.72
Rot. Bonds5

About 1-(3-methyl-2-phenylpentyl)piperazine

1-(3-methyl-2-phenylpentyl)piperazine (PubChem CID 62488695) has the molecular formula C16H26N2 and a molecular weight of 246.40 g/mol. Its IUPAC name is 1-(3-methyl-2-phenylpentyl)piperazine.

Molecular Properties

Compound Name1-(3-methyl-2-phenylpentyl)piperazine
PubChem CID62488695
Molecular FormulaC16H26N2
Molecular Weight246.40 g/mol
Exact Mass246.21
IUPAC Name1-(3-methyl-2-phenylpentyl)piperazine
SMILESCCC(C)C(CN1CCNCC1)c1ccccc1
InChIInChI=1S/C16H26N2/c1-3-14(2)16(15-7-5-4-6-8-15)13-18-11-9-17-10-12-18/h4-8,14,16-17H,3,9-13H2,1-2H3
InChIKeyGAQKGWMGCAUZHP-UHFFFAOYSA-N
XLogP2.72
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.40
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(2R)-3-ethyl-2-phenylpentyl]pyrrolidine
CID 71001431
piperazin-1-ylmethyl 2-phenylpropanoate
CID 90094069
1-(2-phenyl-2-pyridin-4-ylethyl)piperazine
CID 70241433
1-[2-(2-fluorophenyl)-3-methylbutyl]piperazine
CID 82131506
1-[(1R)-1-phenylpropyl]piperazine;dihydrochloride
CID 171295514
2-(1,4-diazepan-1-yl)-1-phenylethanamine
CID 63771215
1-[bromo(phenyl)methyl]piperazine
CID 174618409
1-[2-(3-methylphenyl)propyl]piperazine
CID 82509212
1-[(1S)-2-methyl-1-(3-phenoxyphenyl)butyl]piperazine
CID 171305102
2-methyl-1-(4-phenoxyphenyl)-3-piperazin-1-ylpropan-1-one
CID 82266153
1-[2-(3,5-dimethylpiperidin-1-yl)-2-phenylethyl]piperazine
CID 82201637
1-[2-(4-propan-2-ylphenyl)propyl]piperazine
CID 82295556

Frequently Asked Questions

What is the IUPAC name of 1-(3-methyl-2-phenylpentyl)piperazine?
The IUPAC name of 1-(3-methyl-2-phenylpentyl)piperazine (CID 62488695) is 1-(3-methyl-2-phenylpentyl)piperazine.
What is the SMILES notation for 1-(3-methyl-2-phenylpentyl)piperazine?
The canonical SMILES for 1-(3-methyl-2-phenylpentyl)piperazine is CCC(C)C(CN1CCNCC1)c1ccccc1.
What is the InChIKey of 1-(3-methyl-2-phenylpentyl)piperazine?
The InChIKey is GAQKGWMGCAUZHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2/c1-3-14(2)16(15-7-5-4-6-8-15)13-18-11-9-17-10-12-18/h4-8,14,16-17H,3,9-13H2,1-2H3.
What are the key properties of 1-(3-methyl-2-phenylpentyl)piperazine?
1-(3-methyl-2-phenylpentyl)piperazine has a molecular weight of 246.40 g/mol, XLogP of 2.72, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methyl-2-phenylpentyl)piperazine is sourced from PubChem (CID 62488695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).