1-methyl-4-(2-propan-2-yloxyethyl)piperazine

C10H22N2O — CID 59833512

IUPAC1-methyl-4-(2-propan-2-yloxyethyl)piperazine
SMILESCC(C)OCCN1CCN(C)CC1
InChIInChI=1S/C10H22N2O/c1-10(2)13-9-8-12-6-4-11(3)5-7-12/h10H,4-9H2,1-3H3
InChIKeyHGAWXYXEIYMVCH-UHFFFAOYSA-N
MW186.30 g/mol
LogP0.66
Rot. Bonds4

About 1-methyl-4-(2-propan-2-yloxyethyl)piperazine

1-methyl-4-(2-propan-2-yloxyethyl)piperazine (PubChem CID 59833512) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is 1-methyl-4-(2-propan-2-yloxyethyl)piperazine.

Molecular Properties

Compound Name1-methyl-4-(2-propan-2-yloxyethyl)piperazine
PubChem CID59833512
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC Name1-methyl-4-(2-propan-2-yloxyethyl)piperazine
SMILESCC(C)OCCN1CCN(C)CC1
InChIInChI=1S/C10H22N2O/c1-10(2)13-9-8-12-6-4-11(3)5-7-12/h10H,4-9H2,1-3H3
InChIKeyHGAWXYXEIYMVCH-UHFFFAOYSA-N
XLogP0.66
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 50.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-(2-propan-2-yloxyethyl)piperazine?
The IUPAC name of 1-methyl-4-(2-propan-2-yloxyethyl)piperazine (CID 59833512) is 1-methyl-4-(2-propan-2-yloxyethyl)piperazine.
What is the SMILES notation for 1-methyl-4-(2-propan-2-yloxyethyl)piperazine?
The canonical SMILES for 1-methyl-4-(2-propan-2-yloxyethyl)piperazine is CC(C)OCCN1CCN(C)CC1.
What is the InChIKey of 1-methyl-4-(2-propan-2-yloxyethyl)piperazine?
The InChIKey is HGAWXYXEIYMVCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O/c1-10(2)13-9-8-12-6-4-11(3)5-7-12/h10H,4-9H2,1-3H3.
What are the key properties of 1-methyl-4-(2-propan-2-yloxyethyl)piperazine?
1-methyl-4-(2-propan-2-yloxyethyl)piperazine has a molecular weight of 186.30 g/mol, XLogP of 0.66, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-(2-propan-2-yloxyethyl)piperazine is sourced from PubChem (CID 59833512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).