1-(2,3-dihydro-1,4-benzodioxin-5-ylmethyl)-2,4-dimethylpiperazine

C15H22N2O2 — CID 154748269

IUPAC1-(2,3-dihydro-1,4-benzodioxin-5-ylmethyl)-2,4-dimethylpiperazine
SMILESCC1CN(C)CCN1Cc1cccc2c1OCCO2
InChIInChI=1S/C15H22N2O2/c1-12-10-16(2)6-7-17(12)11-13-4-3-5-14-15(13)19-9-8-18-14/h3-5,12H,6-11H2,1-2H3
InChIKeyUAXSUFAUZYWTTF-UHFFFAOYSA-N
MW262.35 g/mol
LogP1.59
Rot. Bonds2

About 1-(2,3-dihydro-1,4-benzodioxin-5-ylmethyl)-2,4-dimethylpiperazine

1-(2,3-dihydro-1,4-benzodioxin-5-ylmethyl)-2,4-dimethylpiperazine (PubChem CID 154748269) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 1-(2,3-dihydro-1,4-benzodioxin-5-ylmethyl)-2,4-dimethylpiperazine.

Molecular Properties

Compound Name1-(2,3-dihydro-1,4-benzodioxin-5-ylmethyl)-2,4-dimethylpiperazine
PubChem CID154748269
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name1-(2,3-dihydro-1,4-benzodioxin-5-ylmethyl)-2,4-dimethylpiperazine
SMILESCC1CN(C)CCN1Cc1cccc2c1OCCO2
InChIInChI=1S/C15H22N2O2/c1-12-10-16(2)6-7-17(12)11-13-4-3-5-14-15(13)19-9-8-18-14/h3-5,12H,6-11H2,1-2H3
InChIKeyUAXSUFAUZYWTTF-UHFFFAOYSA-N
XLogP1.59
TPSA24.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 51.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydro-1,4-benzodioxin-5-ylmethyl)-2,4-dimethylpiperazine?
The IUPAC name of 1-(2,3-dihydro-1,4-benzodioxin-5-ylmethyl)-2,4-dimethylpiperazine (CID 154748269) is 1-(2,3-dihydro-1,4-benzodioxin-5-ylmethyl)-2,4-dimethylpiperazine.
What is the SMILES notation for 1-(2,3-dihydro-1,4-benzodioxin-5-ylmethyl)-2,4-dimethylpiperazine?
The canonical SMILES for 1-(2,3-dihydro-1,4-benzodioxin-5-ylmethyl)-2,4-dimethylpiperazine is CC1CN(C)CCN1Cc1cccc2c1OCCO2.
What is the InChIKey of 1-(2,3-dihydro-1,4-benzodioxin-5-ylmethyl)-2,4-dimethylpiperazine?
The InChIKey is UAXSUFAUZYWTTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-12-10-16(2)6-7-17(12)11-13-4-3-5-14-15(13)19-9-8-18-14/h3-5,12H,6-11H2,1-2H3.
What are the key properties of 1-(2,3-dihydro-1,4-benzodioxin-5-ylmethyl)-2,4-dimethylpiperazine?
1-(2,3-dihydro-1,4-benzodioxin-5-ylmethyl)-2,4-dimethylpiperazine has a molecular weight of 262.35 g/mol, XLogP of 1.59, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydro-1,4-benzodioxin-5-ylmethyl)-2,4-dimethylpiperazine is sourced from PubChem (CID 154748269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).