(2R)-1-dodecyl-2-methylpiperazine

C17H36N2 — CID 82761023

IUPAC(2R)-1-dodecyl-2-methylpiperazine
SMILESCCCCCCCCCCCCN1CCNC[C@H]1C
InChIInChI=1S/C17H36N2/c1-3-4-5-6-7-8-9-10-11-12-14-19-15-13-18-16-17(19)2/h17-18H,3-16H2,1-2H3/t17-/m1/s1
InChIKeyCPPIAMJUTGLSQI-QGZVFWFLSA-N
MW268.49 g/mol
LogP4.20
Rot. Bonds11

About (2R)-1-dodecyl-2-methylpiperazine

(2R)-1-dodecyl-2-methylpiperazine (PubChem CID 82761023) has the molecular formula C17H36N2 and a molecular weight of 268.49 g/mol. Its IUPAC name is (2R)-1-dodecyl-2-methylpiperazine.

Molecular Properties

Compound Name(2R)-1-dodecyl-2-methylpiperazine
PubChem CID82761023
Molecular FormulaC17H36N2
Molecular Weight268.49 g/mol
Exact Mass268.29
IUPAC Name(2R)-1-dodecyl-2-methylpiperazine
SMILESCCCCCCCCCCCCN1CCNC[C@H]1C
InChIInChI=1S/C17H36N2/c1-3-4-5-6-7-8-9-10-11-12-14-19-15-13-18-16-17(19)2/h17-18H,3-16H2,1-2H3/t17-/m1/s1
InChIKeyCPPIAMJUTGLSQI-QGZVFWFLSA-N
XLogP4.20
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.49
LogP ≤ 54.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

methanol;2-methyl-1-nonylpiperazine
CID 144711987
1-hexyl-7-methyl-1,4-diazepane
CID 64870586
7-(2-methylpiperazin-1-yl)heptanenitrile
CID 50999683
(2R)-1-(3-fluoropropyl)-2-methylpiperazine
CID 82761622
2-cyclohexyl-1-hexylpiperazine
CID 64846644
2-methyl-1-(4-methylpentyl)piperazine
CID 64931123
1-(3-methoxypropyl)-2-methylpiperazine
CID 62674205
(2S)-2-methyl-1-(4,4,4-trifluorobutyl)piperazine
CID 82756199
(2R)-1-(2-fluoroethyl)-2-methylpiperazine
CID 82761196
2-(1-heptylpiperazin-2-yl)acetaldehyde
CID 54004114
1-[3-(2-methoxyethoxy)propyl]-2-methylpiperazine
CID 103410154
2-methyl-1-(4-propan-2-yloxybutyl)piperazine
CID 106008832

Frequently Asked Questions

What is the IUPAC name of (2R)-1-dodecyl-2-methylpiperazine?
The IUPAC name of (2R)-1-dodecyl-2-methylpiperazine (CID 82761023) is (2R)-1-dodecyl-2-methylpiperazine.
What is the SMILES notation for (2R)-1-dodecyl-2-methylpiperazine?
The canonical SMILES for (2R)-1-dodecyl-2-methylpiperazine is CCCCCCCCCCCCN1CCNC[C@H]1C.
What is the InChIKey of (2R)-1-dodecyl-2-methylpiperazine?
The InChIKey is CPPIAMJUTGLSQI-QGZVFWFLSA-N. The full InChI is InChI=1S/C17H36N2/c1-3-4-5-6-7-8-9-10-11-12-14-19-15-13-18-16-17(19)2/h17-18H,3-16H2,1-2H3/t17-/m1/s1.
What are the key properties of (2R)-1-dodecyl-2-methylpiperazine?
(2R)-1-dodecyl-2-methylpiperazine has a molecular weight of 268.49 g/mol, XLogP of 4.20, 11 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-dodecyl-2-methylpiperazine is sourced from PubChem (CID 82761023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).