(2R)-2-(2-methylprop-2-enoxymethyl)piperazine

C9H18N2O — CID 69214785

IUPAC(2R)-2-(2-methylprop-2-enoxymethyl)piperazine
SMILESC=C(C)COC[C@H]1CNCCN1
InChIInChI=1S/C9H18N2O/c1-8(2)6-12-7-9-5-10-3-4-11-9/h9-11H,1,3-7H2,2H3/t9-/m1/s1
InChIKeyBRBYJVMYZXNIDG-SECBINFHSA-N
MW170.26 g/mol
LogP0.14
Rot. Bonds4

About (2R)-2-(2-methylprop-2-enoxymethyl)piperazine

(2R)-2-(2-methylprop-2-enoxymethyl)piperazine (PubChem CID 69214785) has the molecular formula C9H18N2O and a molecular weight of 170.26 g/mol. Its IUPAC name is (2R)-2-(2-methylprop-2-enoxymethyl)piperazine.

Molecular Properties

Compound Name(2R)-2-(2-methylprop-2-enoxymethyl)piperazine
PubChem CID69214785
Molecular FormulaC9H18N2O
Molecular Weight170.26 g/mol
Exact Mass170.14
IUPAC Name(2R)-2-(2-methylprop-2-enoxymethyl)piperazine
SMILESC=C(C)COC[C@H]1CNCCN1
InChIInChI=1S/C9H18N2O/c1-8(2)6-12-7-9-5-10-3-4-11-9/h9-11H,1,3-7H2,2H3/t9-/m1/s1
InChIKeyBRBYJVMYZXNIDG-SECBINFHSA-N
XLogP0.14
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.26
LogP ≤ 50.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

2-(2-Methylprop-2-enoxymethyl)piperazine
CID 58625933
2-(Prop-2-enoxymethyl)piperazine
CID 58625987
2-methyl-N-(2-morpholin-4-ylethyl)prop-2-en-1-amine
CID 60687136
(2R)-2-(prop-1-en-2-yloxymethyl)piperazine
CID 69215395
ethane;2-methylbut-2-ene;N-methyl-N-(morpholin-3-ylmethyl)propan-1-amine
CID 142067927
2-methyl-N-(1-morpholin-4-ylpropan-2-yl)prop-2-en-1-amine
CID 62331538
N-ethyl-2-methyl-N-(morpholin-3-ylmethyl)prop-2-en-1-amine
CID 65520502
1-{2-[(3-Methylbut-2-en-1-yl)oxy]ethyl}piperazine
CID 71378047
1-[2-(2-Methylprop-2-enoxy)ethyl]piperazine
CID 82353032
3-methyl-N-(1-morpholin-4-ylpropan-2-yl)but-2-en-1-amine
CID 106546980
2-(2-methylprop-2-enoxy)-N-(piperidin-2-ylmethyl)ethanamine
CID 106634499
N'-tert-butyl-N-[2-(2-methylprop-2-enoxy)ethyl]ethane-1,2-diamine
CID 107446237

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(2-methylprop-2-enoxymethyl)piperazine?
The IUPAC name of (2R)-2-(2-methylprop-2-enoxymethyl)piperazine (CID 69214785) is (2R)-2-(2-methylprop-2-enoxymethyl)piperazine.
What is the SMILES notation for (2R)-2-(2-methylprop-2-enoxymethyl)piperazine?
The canonical SMILES for (2R)-2-(2-methylprop-2-enoxymethyl)piperazine is C=C(C)COC[C@H]1CNCCN1.
What is the InChIKey of (2R)-2-(2-methylprop-2-enoxymethyl)piperazine?
The InChIKey is BRBYJVMYZXNIDG-SECBINFHSA-N. The full InChI is InChI=1S/C9H18N2O/c1-8(2)6-12-7-9-5-10-3-4-11-9/h9-11H,1,3-7H2,2H3/t9-/m1/s1.
What are the key properties of (2R)-2-(2-methylprop-2-enoxymethyl)piperazine?
(2R)-2-(2-methylprop-2-enoxymethyl)piperazine has a molecular weight of 170.26 g/mol, XLogP of 0.14, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(2-methylprop-2-enoxymethyl)piperazine is sourced from PubChem (CID 69214785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).