1-(3-ethoxypropyl)-2-phenylpiperazine

C15H24N2O — CID 64938444

IUPAC1-(3-ethoxypropyl)-2-phenylpiperazine
SMILESCCOCCCN1CCNCC1c1ccccc1
InChIInChI=1S/C15H24N2O/c1-2-18-12-6-10-17-11-9-16-13-15(17)14-7-4-3-5-8-14/h3-5,7-8,15-16H,2,6,9-13H2,1H3
InChIKeyPVFIOTXECHLOGL-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.06
Rot. Bonds6

About 1-(3-ethoxypropyl)-2-phenylpiperazine

1-(3-ethoxypropyl)-2-phenylpiperazine (PubChem CID 64938444) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 1-(3-ethoxypropyl)-2-phenylpiperazine.

Molecular Properties

Compound Name1-(3-ethoxypropyl)-2-phenylpiperazine
PubChem CID64938444
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name1-(3-ethoxypropyl)-2-phenylpiperazine
SMILESCCOCCCN1CCNCC1c1ccccc1
InChIInChI=1S/C15H24N2O/c1-2-18-12-6-10-17-11-9-16-13-15(17)14-7-4-3-5-8-14/h3-5,7-8,15-16H,2,6,9-13H2,1H3
InChIKeyPVFIOTXECHLOGL-UHFFFAOYSA-N
XLogP2.06
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-(3-fluoropropyl)-2-phenylpiperazine
CID 81114300
1-(7-methyloctyl)-2-phenylpiperazine
CID 107818420
1-(3-ethoxypropyl)-2-phenyl-5-propan-2-ylpiperazine
CID 64953087
2-phenyl-1-propyl-1,4-diazepane
CID 82242016
1-(cyclobutylmethyl)-2-phenylpiperazine
CID 64936519
1-(cyclopentylmethyl)-2-phenylpiperazine
CID 64832948
trimethyl-[(2-phenylpiperazin-1-yl)methyl]silane
CID 10444724
2-(2-phenylpiperazin-1-yl)ethyl 3-oxobutanoate
CID 57179690
2-benzyl-1-(2-ethoxyethyl)piperazine
CID 64845833
4,6-dimethyl-2-[2-(2-phenylpiperazin-1-yl)ethoxy]pyrimidine;hydrochloride
CID 142664543
1-(oxan-4-ylmethyl)-2-phenylpiperazine
CID 64834544
1-[(1-ethylcyclopropyl)methyl]-2-phenylpiperazine
CID 114102162

Frequently Asked Questions

What is the IUPAC name of 1-(3-ethoxypropyl)-2-phenylpiperazine?
The IUPAC name of 1-(3-ethoxypropyl)-2-phenylpiperazine (CID 64938444) is 1-(3-ethoxypropyl)-2-phenylpiperazine.
What is the SMILES notation for 1-(3-ethoxypropyl)-2-phenylpiperazine?
The canonical SMILES for 1-(3-ethoxypropyl)-2-phenylpiperazine is CCOCCCN1CCNCC1c1ccccc1.
What is the InChIKey of 1-(3-ethoxypropyl)-2-phenylpiperazine?
The InChIKey is PVFIOTXECHLOGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-2-18-12-6-10-17-11-9-16-13-15(17)14-7-4-3-5-8-14/h3-5,7-8,15-16H,2,6,9-13H2,1H3.
What are the key properties of 1-(3-ethoxypropyl)-2-phenylpiperazine?
1-(3-ethoxypropyl)-2-phenylpiperazine has a molecular weight of 248.37 g/mol, XLogP of 2.06, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-ethoxypropyl)-2-phenylpiperazine is sourced from PubChem (CID 64938444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).