2-(4-methoxy-2-methyl-5-propan-2-ylphenyl)piperazine

C15H24N2O — CID 82296694

IUPAC2-(4-methoxy-2-methyl-5-propan-2-ylphenyl)piperazine
SMILESCOc1cc(C)c(C2CNCCN2)cc1C(C)C
InChIInChI=1S/C15H24N2O/c1-10(2)12-8-13(11(3)7-15(12)18-4)14-9-16-5-6-17-14/h7-8,10,14,16-17H,5-6,9H2,1-4H3
InChIKeyGLDQMTGPSASLNS-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.36
Rot. Bonds3

About 2-(4-methoxy-2-methyl-5-propan-2-ylphenyl)piperazine

2-(4-methoxy-2-methyl-5-propan-2-ylphenyl)piperazine (PubChem CID 82296694) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is 2-(4-methoxy-2-methyl-5-propan-2-ylphenyl)piperazine.

Molecular Properties

Compound Name2-(4-methoxy-2-methyl-5-propan-2-ylphenyl)piperazine
PubChem CID82296694
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name2-(4-methoxy-2-methyl-5-propan-2-ylphenyl)piperazine
SMILESCOc1cc(C)c(C2CNCCN2)cc1C(C)C
InChIInChI=1S/C15H24N2O/c1-10(2)12-8-13(11(3)7-15(12)18-4)14-9-16-5-6-17-14/h7-8,10,14,16-17H,5-6,9H2,1-4H3
InChIKeyGLDQMTGPSASLNS-UHFFFAOYSA-N
XLogP2.36
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(5-tert-butyl-4-methoxy-2-methylphenyl)piperazine
CID 82302997
(2S)-2-(4,5-dimethoxy-2-methylphenyl)aziridine
CID 55263982
2-(2,5-difluoro-4-methoxyphenyl)piperazine
CID 116856206
(2R)-2-(2,4-dimethoxyphenyl)piperazine;hydrochloride
CID 171194245
2-(5-bromo-2-methoxyphenyl)piperazine
CID 82093166
(2S)-2-(2,4-dimethylphenyl)piperazine
CID 55264314
azetidin-3-yl-(4-methoxy-2-methyl-5-propan-2-ylphenyl)methanamine
CID 116935315
2-(2,5-dimethoxy-4-propan-2-ylphenyl)piperidine
CID 117413709
(2R)-2-(2,4-dimethylphenyl)piperazine;hydrochloride
CID 171194638
4-fluoro-2-methoxy-6-[(2R)-piperazin-2-yl]phenol
CID 171259704
4,5-dimethoxy-2-[(2R)-piperazin-2-yl]benzoic acid
CID 165348809
3-methyl-4-[(2S)-piperazin-2-yl]aniline
CID 130956222

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxy-2-methyl-5-propan-2-ylphenyl)piperazine?
The IUPAC name of 2-(4-methoxy-2-methyl-5-propan-2-ylphenyl)piperazine (CID 82296694) is 2-(4-methoxy-2-methyl-5-propan-2-ylphenyl)piperazine.
What is the SMILES notation for 2-(4-methoxy-2-methyl-5-propan-2-ylphenyl)piperazine?
The canonical SMILES for 2-(4-methoxy-2-methyl-5-propan-2-ylphenyl)piperazine is COc1cc(C)c(C2CNCCN2)cc1C(C)C.
What is the InChIKey of 2-(4-methoxy-2-methyl-5-propan-2-ylphenyl)piperazine?
The InChIKey is GLDQMTGPSASLNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-10(2)12-8-13(11(3)7-15(12)18-4)14-9-16-5-6-17-14/h7-8,10,14,16-17H,5-6,9H2,1-4H3.
What are the key properties of 2-(4-methoxy-2-methyl-5-propan-2-ylphenyl)piperazine?
2-(4-methoxy-2-methyl-5-propan-2-ylphenyl)piperazine has a molecular weight of 248.37 g/mol, XLogP of 2.36, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxy-2-methyl-5-propan-2-ylphenyl)piperazine is sourced from PubChem (CID 82296694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).