1-(2,4-dimethoxyphenyl)-2-propan-2-ylpiperazine

C15H24N2O2 — CID 64938228

IUPAC1-(2,4-dimethoxyphenyl)-2-propan-2-ylpiperazine
SMILESCOc1ccc(N2CCNCC2C(C)C)c(OC)c1
InChIInChI=1S/C15H24N2O2/c1-11(2)14-10-16-7-8-17(14)13-6-5-12(18-3)9-15(13)19-4/h5-6,9,11,14,16H,7-8,10H2,1-4H3
InChIKeyPOZUZDOPZPXXNS-UHFFFAOYSA-N
MW264.37 g/mol
LogP2.14
Rot. Bonds4

About 1-(2,4-dimethoxyphenyl)-2-propan-2-ylpiperazine

1-(2,4-dimethoxyphenyl)-2-propan-2-ylpiperazine (PubChem CID 64938228) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 1-(2,4-dimethoxyphenyl)-2-propan-2-ylpiperazine.

Molecular Properties

Compound Name1-(2,4-dimethoxyphenyl)-2-propan-2-ylpiperazine
PubChem CID64938228
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name1-(2,4-dimethoxyphenyl)-2-propan-2-ylpiperazine
SMILESCOc1ccc(N2CCNCC2C(C)C)c(OC)c1
InChIInChI=1S/C15H24N2O2/c1-11(2)14-10-16-7-8-17(14)13-6-5-12(18-3)9-15(13)19-4/h5-6,9,11,14,16H,7-8,10H2,1-4H3
InChIKeyPOZUZDOPZPXXNS-UHFFFAOYSA-N
XLogP2.14
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-(2,4-dimethoxyphenyl)-2-propan-2-ylpiperazine?
The IUPAC name of 1-(2,4-dimethoxyphenyl)-2-propan-2-ylpiperazine (CID 64938228) is 1-(2,4-dimethoxyphenyl)-2-propan-2-ylpiperazine.
What is the SMILES notation for 1-(2,4-dimethoxyphenyl)-2-propan-2-ylpiperazine?
The canonical SMILES for 1-(2,4-dimethoxyphenyl)-2-propan-2-ylpiperazine is COc1ccc(N2CCNCC2C(C)C)c(OC)c1.
What is the InChIKey of 1-(2,4-dimethoxyphenyl)-2-propan-2-ylpiperazine?
The InChIKey is POZUZDOPZPXXNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-11(2)14-10-16-7-8-17(14)13-6-5-12(18-3)9-15(13)19-4/h5-6,9,11,14,16H,7-8,10H2,1-4H3.
What are the key properties of 1-(2,4-dimethoxyphenyl)-2-propan-2-ylpiperazine?
1-(2,4-dimethoxyphenyl)-2-propan-2-ylpiperazine has a molecular weight of 264.37 g/mol, XLogP of 2.14, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-dimethoxyphenyl)-2-propan-2-ylpiperazine is sourced from PubChem (CID 64938228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).