2,2-dimethyl-4-[1-[(2-methylpropan-2-yl)oxy]ethyl]-1-propan-2-ylpiperazine

C15H32N2O — CID 121368755

IUPAC2,2-dimethyl-4-[1-[(2-methylpropan-2-yl)oxy]ethyl]-1-propan-2-ylpiperazine
SMILESCC(OC(C)(C)C)N1CCN(C(C)C)C(C)(C)C1
InChIInChI=1S/C15H32N2O/c1-12(2)17-10-9-16(11-15(17,7)8)13(3)18-14(4,5)6/h12-13H,9-11H2,1-8H3
InChIKeyWJLACWIUGRLBAB-UHFFFAOYSA-N
MW256.43 g/mol
LogP2.95
Rot. Bonds3

About 2,2-dimethyl-4-[1-[(2-methylpropan-2-yl)oxy]ethyl]-1-propan-2-ylpiperazine

2,2-dimethyl-4-[1-[(2-methylpropan-2-yl)oxy]ethyl]-1-propan-2-ylpiperazine (PubChem CID 121368755) has the molecular formula C15H32N2O and a molecular weight of 256.43 g/mol. Its IUPAC name is 2,2-dimethyl-4-[1-[(2-methylpropan-2-yl)oxy]ethyl]-1-propan-2-ylpiperazine.

Molecular Properties

Compound Name2,2-dimethyl-4-[1-[(2-methylpropan-2-yl)oxy]ethyl]-1-propan-2-ylpiperazine
PubChem CID121368755
Molecular FormulaC15H32N2O
Molecular Weight256.43 g/mol
Exact Mass256.25
IUPAC Name2,2-dimethyl-4-[1-[(2-methylpropan-2-yl)oxy]ethyl]-1-propan-2-ylpiperazine
SMILESCC(OC(C)(C)C)N1CCN(C(C)C)C(C)(C)C1
InChIInChI=1S/C15H32N2O/c1-12(2)17-10-9-16(11-15(17,7)8)13(3)18-14(4,5)6/h12-13H,9-11H2,1-8H3
InChIKeyWJLACWIUGRLBAB-UHFFFAOYSA-N
XLogP2.95
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.43
LogP ≤ 52.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2,2,4-trimethyl-1-propan-2-ylpiperazine
CID 121368614
4-ethynyl-2,2-dimethyl-1-propan-2-ylpiperazine
CID 130399561
3,3-dimethyl-4-propan-2-ylthiomorpholine
CID 130717092
1-[3-[(2-methylpropan-2-yl)oxy]propyl]-4-propan-2-ylpiperazine
CID 155296815
2,2-difluoro-1,3-di(propan-2-yl)-1,3-diazinane
CID 139944450
1-(1-methoxyethyl)aziridine
CID 87933654
1,1-difluoroethane;bis(2,2-dimethyl-1,4-di(propan-2-yl)piperazine);bis((2R,6S)-2,6-dimethyl-1,4-di(propan-2-yl)piperazine);bis((2R,6R)-2,6-dimethyl-1,4-di(propan-2-yl)piperazine);hexakis(1,4-di(propan-2-yl)piperazine);bis(1,3-di(propan-2-yl)piperidine);ethane;fluoromethane;hydroperoxyethane;bis(1-methyl-2,4-di(propan-2-yl)piperazine)
CID 165065579
1,6,6-trimethyl-4-propan-2-yl-1,4-diazepane
CID 143841678
1-[methoxy-[(2-methylpropan-2-yl)oxy]methyl]pyrrolidine
CID 142366745
2-propan-2-yl-2,7-diazaspiro[3.5]nonan-7-amine
CID 134436171
tert-butyl 2-(2,2-dimethylpyrrolidin-1-yl)propanoate
CID 64688779
4,4,4-trifluoro-3-(3,3,4-trimethylpiperazin-1-yl)butan-2-amine
CID 63603323

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-4-[1-[(2-methylpropan-2-yl)oxy]ethyl]-1-propan-2-ylpiperazine?
The IUPAC name of 2,2-dimethyl-4-[1-[(2-methylpropan-2-yl)oxy]ethyl]-1-propan-2-ylpiperazine (CID 121368755) is 2,2-dimethyl-4-[1-[(2-methylpropan-2-yl)oxy]ethyl]-1-propan-2-ylpiperazine.
What is the SMILES notation for 2,2-dimethyl-4-[1-[(2-methylpropan-2-yl)oxy]ethyl]-1-propan-2-ylpiperazine?
The canonical SMILES for 2,2-dimethyl-4-[1-[(2-methylpropan-2-yl)oxy]ethyl]-1-propan-2-ylpiperazine is CC(OC(C)(C)C)N1CCN(C(C)C)C(C)(C)C1.
What is the InChIKey of 2,2-dimethyl-4-[1-[(2-methylpropan-2-yl)oxy]ethyl]-1-propan-2-ylpiperazine?
The InChIKey is WJLACWIUGRLBAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32N2O/c1-12(2)17-10-9-16(11-15(17,7)8)13(3)18-14(4,5)6/h12-13H,9-11H2,1-8H3.
What are the key properties of 2,2-dimethyl-4-[1-[(2-methylpropan-2-yl)oxy]ethyl]-1-propan-2-ylpiperazine?
2,2-dimethyl-4-[1-[(2-methylpropan-2-yl)oxy]ethyl]-1-propan-2-ylpiperazine has a molecular weight of 256.43 g/mol, XLogP of 2.95, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-4-[1-[(2-methylpropan-2-yl)oxy]ethyl]-1-propan-2-ylpiperazine is sourced from PubChem (CID 121368755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).