1-(4-methoxyphenyl)-4-propylpiperazine

C14H22N2O — CID 12854846

IUPAC1-(4-methoxyphenyl)-4-propylpiperazine
SMILESCCCN1CCN(c2ccc(OC)cc2)CC1
InChIInChI=1S/C14H22N2O/c1-3-8-15-9-11-16(12-10-15)13-4-6-14(17-2)7-5-13/h4-7H,3,8-12H2,1-2H3
InChIKeyBXDRXWBCUJCURL-UHFFFAOYSA-N
MW234.34 g/mol
LogP2.23
Rot. Bonds4

About 1-(4-methoxyphenyl)-4-propylpiperazine

1-(4-methoxyphenyl)-4-propylpiperazine (PubChem CID 12854846) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is 1-(4-methoxyphenyl)-4-propylpiperazine.

Molecular Properties

Compound Name1-(4-methoxyphenyl)-4-propylpiperazine
PubChem CID12854846
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name1-(4-methoxyphenyl)-4-propylpiperazine
SMILESCCCN1CCN(c2ccc(OC)cc2)CC1
InChIInChI=1S/C14H22N2O/c1-3-8-15-9-11-16(12-10-15)13-4-6-14(17-2)7-5-13/h4-7H,3,8-12H2,1-2H3
InChIKeyBXDRXWBCUJCURL-UHFFFAOYSA-N
XLogP2.23
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 52.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}

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Related Compounds

1-(4-methoxyphenyl)-4-(2-piperidin-1-ylethyl)piperazine
CID 1439447
4-[4-(4-methoxyphenyl)piperazin-1-yl]butan-1-amine;hydrochloride
CID 68547015
N-ethyl-4-[4-(4-methoxyphenyl)piperazin-1-yl]butan-1-amine
CID 62425678
1-(4-methoxyphenyl)-4-[3-(4-methoxyphenyl)butyl]piperazine
CID 71277666
6-[4-(4-methoxyphenyl)piperazin-1-yl]hexan-3-ol
CID 106802258
1-(4-fluorophenyl)-4-[2-(4-methoxyphenyl)ethyl]piperazine
CID 15527072
1-[4-(4-methoxyphenyl)piperazin-1-yl]pentan-2-amine
CID 43650418
ethane;1-(4-ethylphenyl)-4-propylpiperazine
CID 170586742
1-(4-methoxyphenyl)-4-sulfanylpiperazine;propane
CID 142914389
3-(4-ethylpiperazin-1-yl)-1-[4-(4-methoxyphenyl)piperazin-1-yl]propan-1-one
CID 109017688
4-[4-(4-methoxyphenyl)piperazin-1-yl]butanethioamide
CID 24693485
1-butyl-3-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl]-2-methylguanidine
CID 111151872

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxyphenyl)-4-propylpiperazine?
The IUPAC name of 1-(4-methoxyphenyl)-4-propylpiperazine (CID 12854846) is 1-(4-methoxyphenyl)-4-propylpiperazine.
What is the SMILES notation for 1-(4-methoxyphenyl)-4-propylpiperazine?
The canonical SMILES for 1-(4-methoxyphenyl)-4-propylpiperazine is CCCN1CCN(c2ccc(OC)cc2)CC1.
What is the InChIKey of 1-(4-methoxyphenyl)-4-propylpiperazine?
The InChIKey is BXDRXWBCUJCURL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-3-8-15-9-11-16(12-10-15)13-4-6-14(17-2)7-5-13/h4-7H,3,8-12H2,1-2H3.
What are the key properties of 1-(4-methoxyphenyl)-4-propylpiperazine?
1-(4-methoxyphenyl)-4-propylpiperazine has a molecular weight of 234.34 g/mol, XLogP of 2.23, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxyphenyl)-4-propylpiperazine is sourced from PubChem (CID 12854846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).