1,4-bis[(2-methylpropan-2-yl)oxymethyl]piperazine

C14H30N2O2 — CID 164817435

IUPAC1,4-bis[(2-methylpropan-2-yl)oxymethyl]piperazine
SMILESCC(C)(C)OCN1CCN(COC(C)(C)C)CC1
InChIInChI=1S/C14H30N2O2/c1-13(2,3)17-11-15-7-9-16(10-8-15)12-18-14(4,5)6/h7-12H2,1-6H3
InChIKeyULDVSMDOIWYAST-UHFFFAOYSA-N
MW258.41 g/mol
LogP2.15
Rot. Bonds4

About 1,4-bis[(2-methylpropan-2-yl)oxymethyl]piperazine

1,4-bis[(2-methylpropan-2-yl)oxymethyl]piperazine (PubChem CID 164817435) has the molecular formula C14H30N2O2 and a molecular weight of 258.41 g/mol. Its IUPAC name is 1,4-bis[(2-methylpropan-2-yl)oxymethyl]piperazine.

Molecular Properties

Compound Name1,4-bis[(2-methylpropan-2-yl)oxymethyl]piperazine
PubChem CID164817435
Molecular FormulaC14H30N2O2
Molecular Weight258.41 g/mol
Exact Mass258.23
IUPAC Name1,4-bis[(2-methylpropan-2-yl)oxymethyl]piperazine
SMILESCC(C)(C)OCN1CCN(COC(C)(C)C)CC1
InChIInChI=1S/C14H30N2O2/c1-13(2,3)17-11-15-7-9-16(10-8-15)12-18-14(4,5)6/h7-12H2,1-6H3
InChIKeyULDVSMDOIWYAST-UHFFFAOYSA-N
XLogP2.15
TPSA24.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.41
LogP ≤ 52.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-(2-bromoethyl)-1-[(2-methylpropan-2-yl)oxymethyl]piperidine
CID 123168061
(1R,5S)-3-[(2-methylpropan-2-yl)oxymethyl]-3-azabicyclo[3.1.0]hexan-6-amine
CID 166905468
1-tert-butyl-4-[2-[(2-methylpropan-2-yl)oxy]ethoxymethyl]piperazine
CID 177085139
1-[(2-methylpropan-2-yl)oxymethyl]azetidine-3-carbaldehyde
CID 90788429
6-methyl-2-[(2-methylpropan-2-yl)oxymethyl]-2-azaspiro[3.3]heptane
CID 145221794
methyl 1-[4-[(2-methylpropan-2-yl)oxymethyl]piperazine-1-carbonyl]pyrrolidine-2-carboxylate
CID 163979459
1,4-bis(methoxymethyl)piperazine
CID 15759078
2-[3-[(2-methylpropan-2-yl)oxymethyl]-3-azaspiro[5.5]undecan-9-yl]acetic acid
CID 90738914
1-[(2-methylpropan-2-yl)oxymethyl]-3-prop-2-enoxypyrrolidine
CID 139372320
1-ethyl-4-[3-[(2-methylpropan-2-yl)oxy]propyl]piperazine
CID 171447106
1-[2-[(2-methylpropan-2-yl)oxy]ethyl]-4-(2-propan-2-yloxyethyl)piperazine
CID 135217006
1-tert-butyl-4-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethyl]piperazine
CID 135167668

Frequently Asked Questions

What is the IUPAC name of 1,4-bis[(2-methylpropan-2-yl)oxymethyl]piperazine?
The IUPAC name of 1,4-bis[(2-methylpropan-2-yl)oxymethyl]piperazine (CID 164817435) is 1,4-bis[(2-methylpropan-2-yl)oxymethyl]piperazine.
What is the SMILES notation for 1,4-bis[(2-methylpropan-2-yl)oxymethyl]piperazine?
The canonical SMILES for 1,4-bis[(2-methylpropan-2-yl)oxymethyl]piperazine is CC(C)(C)OCN1CCN(COC(C)(C)C)CC1.
What is the InChIKey of 1,4-bis[(2-methylpropan-2-yl)oxymethyl]piperazine?
The InChIKey is ULDVSMDOIWYAST-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O2/c1-13(2,3)17-11-15-7-9-16(10-8-15)12-18-14(4,5)6/h7-12H2,1-6H3.
What are the key properties of 1,4-bis[(2-methylpropan-2-yl)oxymethyl]piperazine?
1,4-bis[(2-methylpropan-2-yl)oxymethyl]piperazine has a molecular weight of 258.41 g/mol, XLogP of 2.15, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-bis[(2-methylpropan-2-yl)oxymethyl]piperazine is sourced from PubChem (CID 164817435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).