1-(4-Methoxyphenyl)piperazine

C11H16N2O — CID 269722

IUPAC1-(4-methoxyphenyl)piperazine
SMILESCOC1=CC=C(C=C1)N2CCNCC2
InChIInChI=1S/C11H16N2O/c1-14-11-4-2-10(3-5-11)13-8-6-12-7-9-13/h2-5,12H,6-9H2,1H3
InChIKeyMRDGZSKYFPGAKP-UHFFFAOYSA-N
MW192.26 g/mol
LogP1.20
Rot. Bonds2

About 1-(4-Methoxyphenyl)piperazine

1-(4-Methoxyphenyl)piperazine (PubChem CID 269722) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is 1-(4-methoxyphenyl)piperazine.

Molecular Properties

Compound Name1-(4-Methoxyphenyl)piperazine
PubChem CID269722
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name1-(4-methoxyphenyl)piperazine
SMILESCOC1=CC=C(C=C1)N2CCNCC2
InChIInChI=1S/C11H16N2O/c1-14-11-4-2-10(3-5-11)13-8-6-12-7-9-13/h2-5,12H,6-9H2,1H3
InChIKeyMRDGZSKYFPGAKP-UHFFFAOYSA-N
XLogP1.20
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity161

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 51.20
H-Bond Donors ≤ 51
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

N-(4-Methoxyphenyl)Acetamide
CID 5827
4,4'-Dimethoxydiphenylamine
CID 7571
1-(2-Methoxyphenyl)piperazine
CID 1346
4-Isopropoxydiphenylamine
CID 7574
N-(3-methoxyphenyl)piperazine
CID 81430
N-(2-Methoxyphenyl)piperazine hydrochloride
CID 9899402
p-(1-Piperazinyl)phenol
CID 92467
1-(2-Ethoxyphenyl)piperazine
CID 83357
N-(p-Methoxyphenyl)-p-phenylenediamine hydrochloride
CID 77108
1-Piperidinecarboxamide, N-(4-methoxyphenyl)-
CID 200753
1-[2-(Propan-2-yloxy)phenyl]piperazine
CID 10944016
N-Benzyl-4-methoxyaniline
CID 519413

Frequently Asked Questions

What is the IUPAC name of 1-(4-Methoxyphenyl)piperazine?
The IUPAC name of 1-(4-Methoxyphenyl)piperazine (CID 269722) is 1-(4-methoxyphenyl)piperazine.
What is the SMILES notation for 1-(4-Methoxyphenyl)piperazine?
The canonical SMILES for 1-(4-Methoxyphenyl)piperazine is COC1=CC=C(C=C1)N2CCNCC2.
What is the InChIKey of 1-(4-Methoxyphenyl)piperazine?
The InChIKey is MRDGZSKYFPGAKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c1-14-11-4-2-10(3-5-11)13-8-6-12-7-9-13/h2-5,12H,6-9H2,1H3.
What are the key properties of 1-(4-Methoxyphenyl)piperazine?
1-(4-Methoxyphenyl)piperazine has a molecular weight of 192.26 g/mol, XLogP of 1.20, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-Methoxyphenyl)piperazine is sourced from PubChem (CID 269722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).