1-[1-(4-methoxyphenyl)propyl]piperazine

C14H22N2O — CID 3971378

IUPAC1-[1-(4-methoxyphenyl)propyl]piperazine
SMILESCCC(c1ccc(OC)cc1)N1CCNCC1
InChIInChI=1S/C14H22N2O/c1-3-14(16-10-8-15-9-11-16)12-4-6-13(17-2)7-5-12/h4-7,14-15H,3,8-11H2,1-2H3
InChIKeyVBTSRXFCRBHVBR-UHFFFAOYSA-N
MW234.34 g/mol
LogP2.05
Rot. Bonds4

About 1-[1-(4-methoxyphenyl)propyl]piperazine

1-[1-(4-methoxyphenyl)propyl]piperazine (PubChem CID 3971378) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is 1-[1-(4-methoxyphenyl)propyl]piperazine.

Molecular Properties

Compound Name1-[1-(4-methoxyphenyl)propyl]piperazine
PubChem CID3971378
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name1-[1-(4-methoxyphenyl)propyl]piperazine
SMILESCCC(c1ccc(OC)cc1)N1CCNCC1
InChIInChI=1S/C14H22N2O/c1-3-14(16-10-8-15-9-11-16)12-4-6-13(17-2)7-5-12/h4-7,14-15H,3,8-11H2,1-2H3
InChIKeyVBTSRXFCRBHVBR-UHFFFAOYSA-N
XLogP2.05
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(1S)-2-fluoro-1-(4-methoxyphenyl)ethyl]piperazine
CID 171181751
1-[(1S)-2-fluoro-1-(4-methoxyphenyl)ethyl]piperazine;hydrochloride
CID 171181752
1-[1-(4-ethoxyphenyl)propyl]piperazine
CID 3597592
(2R)-2-(4-methoxyphenyl)-2-piperazin-1-ylethanol;hydrochloride
CID 171183352
1-[(1S)-1-[4-[(2-methylpropan-2-yl)oxy]phenyl]propyl]piperazine
CID 95480577
1-[(1R)-3,3-difluoro-1-(4-methoxyphenyl)propyl]piperazine
CID 171175380
1-[(1R)-4,4,4-trifluoro-1-(4-methoxyphenyl)butyl]piperazine
CID 171168617
1-[(1R)-3,3-difluoro-1-(4-methoxyphenyl)propyl]piperazine;hydrochloride
CID 171175381
1-[(1S)-1-(4-methoxyphenyl)-4-methylpentyl]piperazine;dihydrochloride
CID 171309970
1-[(1R)-1-(4-fluorophenyl)propyl]piperazine
CID 28798751
1-[(1S)-1-[4-(trifluoromethoxy)phenyl]propyl]piperazine;dihydrochloride
CID 171279194
1-[(1R)-1-(4-methylphenyl)propyl]piperazine;dihydrochloride
CID 171294154

Frequently Asked Questions

What is the IUPAC name of 1-[1-(4-methoxyphenyl)propyl]piperazine?
The IUPAC name of 1-[1-(4-methoxyphenyl)propyl]piperazine (CID 3971378) is 1-[1-(4-methoxyphenyl)propyl]piperazine.
What is the SMILES notation for 1-[1-(4-methoxyphenyl)propyl]piperazine?
The canonical SMILES for 1-[1-(4-methoxyphenyl)propyl]piperazine is CCC(c1ccc(OC)cc1)N1CCNCC1.
What is the InChIKey of 1-[1-(4-methoxyphenyl)propyl]piperazine?
The InChIKey is VBTSRXFCRBHVBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-3-14(16-10-8-15-9-11-16)12-4-6-13(17-2)7-5-12/h4-7,14-15H,3,8-11H2,1-2H3.
What are the key properties of 1-[1-(4-methoxyphenyl)propyl]piperazine?
1-[1-(4-methoxyphenyl)propyl]piperazine has a molecular weight of 234.34 g/mol, XLogP of 2.05, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(4-methoxyphenyl)propyl]piperazine is sourced from PubChem (CID 3971378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).