1-[(2,5-dimethoxyphenyl)methyl]-3,3-dimethylpiperazine

C15H24N2O2 — CID 82303802

IUPAC1-[(2,5-dimethoxyphenyl)methyl]-3,3-dimethylpiperazine
SMILESCOc1ccc(OC)c(CN2CCNC(C)(C)C2)c1
InChIInChI=1S/C15H24N2O2/c1-15(2)11-17(8-7-16-15)10-12-9-13(18-3)5-6-14(12)19-4/h5-6,9,16H,7-8,10-11H2,1-4H3
InChIKeyVPPBCNLMSSTQMZ-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.89
Rot. Bonds4

About 1-[(2,5-dimethoxyphenyl)methyl]-3,3-dimethylpiperazine

1-[(2,5-dimethoxyphenyl)methyl]-3,3-dimethylpiperazine (PubChem CID 82303802) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 1-[(2,5-dimethoxyphenyl)methyl]-3,3-dimethylpiperazine.

Molecular Properties

Compound Name1-[(2,5-dimethoxyphenyl)methyl]-3,3-dimethylpiperazine
PubChem CID82303802
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name1-[(2,5-dimethoxyphenyl)methyl]-3,3-dimethylpiperazine
SMILESCOc1ccc(OC)c(CN2CCNC(C)(C)C2)c1
InChIInChI=1S/C15H24N2O2/c1-15(2)11-17(8-7-16-15)10-12-9-13(18-3)5-6-14(12)19-4/h5-6,9,16H,7-8,10-11H2,1-4H3
InChIKeyVPPBCNLMSSTQMZ-UHFFFAOYSA-N
XLogP1.89
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 ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[(2,4-dimethoxyphenyl)methyl]-3,3-dimethyl-1,4-diazepane
CID 64951779
2-[(2,5-dimethoxyphenyl)methyl]-2,8-diazaspiro[4.5]decane;hydrochloride
CID 120906879
1-[(3-chloro-4-methoxyphenyl)methyl]-3,3-dimethylpiperazine
CID 82305327
3-cyclopropyl-1-[(2,4-dimethoxyphenyl)methyl]-3-methylpiperazine
CID 64955002
9-[(2-methoxy-5-methylphenyl)methyl]-6,9-diazaspiro[4.5]decane
CID 64833057
1-[(2-bromo-5-methoxyphenyl)methyl]-3-cyclopropyl-3-methylpiperazine
CID 65325766
1-(2,4-dimethoxyphenyl)-3,3-dimethylpiperazine
CID 64924000
1-[(5-fluoro-2-methylphenyl)methyl]-3,3-dimethylpiperazine
CID 115970389
1-[(2,5-dimethoxyphenyl)methyl]azetidin-3-ol
CID 63282227
1-[(2S)-butan-2-yl]-4-[(2,5-dimethoxyphenyl)methyl]piperazine
CID 764461
3-[(3,3-dimethylpiperazin-1-yl)methyl]-4-methylaniline
CID 68626792
[4-[(2,5-dimethoxyphenyl)methyl]-6,6-dimethylmorpholin-2-yl]methanol
CID 114779927

Frequently Asked Questions

What is the IUPAC name of 1-[(2,5-dimethoxyphenyl)methyl]-3,3-dimethylpiperazine?
The IUPAC name of 1-[(2,5-dimethoxyphenyl)methyl]-3,3-dimethylpiperazine (CID 82303802) is 1-[(2,5-dimethoxyphenyl)methyl]-3,3-dimethylpiperazine.
What is the SMILES notation for 1-[(2,5-dimethoxyphenyl)methyl]-3,3-dimethylpiperazine?
The canonical SMILES for 1-[(2,5-dimethoxyphenyl)methyl]-3,3-dimethylpiperazine is COc1ccc(OC)c(CN2CCNC(C)(C)C2)c1.
What is the InChIKey of 1-[(2,5-dimethoxyphenyl)methyl]-3,3-dimethylpiperazine?
The InChIKey is VPPBCNLMSSTQMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-15(2)11-17(8-7-16-15)10-12-9-13(18-3)5-6-14(12)19-4/h5-6,9,16H,7-8,10-11H2,1-4H3.
What are the key properties of 1-[(2,5-dimethoxyphenyl)methyl]-3,3-dimethylpiperazine?
1-[(2,5-dimethoxyphenyl)methyl]-3,3-dimethylpiperazine has a molecular weight of 264.37 g/mol, XLogP of 1.89, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2,5-dimethoxyphenyl)methyl]-3,3-dimethylpiperazine is sourced from PubChem (CID 82303802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).