2-methyl-1-(2-methylprop-2-enyl)piperazine

C9H18N2 — CID 62671724

IUPAC2-methyl-1-(2-methylprop-2-enyl)piperazine
SMILESC=C(C)CN1CCNCC1C
InChIInChI=1S/C9H18N2/c1-8(2)7-11-5-4-10-6-9(11)3/h9-10H,1,4-7H2,2-3H3
InChIKeyMIJZPBIFDHTRPL-UHFFFAOYSA-N
MW154.26 g/mol
LogP0.86
Rot. Bonds2

About 2-methyl-1-(2-methylprop-2-enyl)piperazine

2-methyl-1-(2-methylprop-2-enyl)piperazine (PubChem CID 62671724) has the molecular formula C9H18N2 and a molecular weight of 154.26 g/mol. Its IUPAC name is 2-methyl-1-(2-methylprop-2-enyl)piperazine.

Molecular Properties

Compound Name2-methyl-1-(2-methylprop-2-enyl)piperazine
PubChem CID62671724
Molecular FormulaC9H18N2
Molecular Weight154.26 g/mol
Exact Mass154.15
IUPAC Name2-methyl-1-(2-methylprop-2-enyl)piperazine
SMILESC=C(C)CN1CCNCC1C
InChIInChI=1S/C9H18N2/c1-8(2)7-11-5-4-10-6-9(11)3/h9-10H,1,4-7H2,2-3H3
InChIKeyMIJZPBIFDHTRPL-UHFFFAOYSA-N
XLogP0.86
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.26
LogP ≤ 50.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(-)-(2R,5S)-1-allyl-2,5-dimethylpiperazine
CID 10534891
(+/-)-trans-1-Allyl-2,5-dimethylpiperazine
CID 89312366
1-Allyl-2,5-dimethylpiperazine
CID 4135660
(2S,5R)-1-allyl-2,5-dimethylpiperazine
CID 11291191
N-allyl-3-methylpiperazine
CID 23447962
(3S)-1-[(2Z,4Z)-3-fluoro-2-methylhepta-2,4,6-trienyl]-3-methylpiperazine
CID 142262364
N-propan-2-yl-2-[[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methyl]prop-2-en-1-amine
CID 103070422
N-tert-butyl-2-[[4-(2,2,2-trifluoroethyl)piperazin-1-yl]methyl]prop-2-en-1-amine
CID 103070425
1-(2-Methylallyl)piperazine
CID 1073878
(2S)-1-N-(2-methylprop-2-enyl)propane-1,2-diamine
CID 10011916
1-(3-Methyl-but-2-enyl)-piperazine
CID 10441904
1-(2,3-Dimethylbut-2-enyl)piperazine
CID 20521849

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-(2-methylprop-2-enyl)piperazine?
The IUPAC name of 2-methyl-1-(2-methylprop-2-enyl)piperazine (CID 62671724) is 2-methyl-1-(2-methylprop-2-enyl)piperazine.
What is the SMILES notation for 2-methyl-1-(2-methylprop-2-enyl)piperazine?
The canonical SMILES for 2-methyl-1-(2-methylprop-2-enyl)piperazine is C=C(C)CN1CCNCC1C.
What is the InChIKey of 2-methyl-1-(2-methylprop-2-enyl)piperazine?
The InChIKey is MIJZPBIFDHTRPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2/c1-8(2)7-11-5-4-10-6-9(11)3/h9-10H,1,4-7H2,2-3H3.
What are the key properties of 2-methyl-1-(2-methylprop-2-enyl)piperazine?
2-methyl-1-(2-methylprop-2-enyl)piperazine has a molecular weight of 154.26 g/mol, XLogP of 0.86, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(2-methylprop-2-enyl)piperazine is sourced from PubChem (CID 62671724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).