3-methyl-1-[(1-methylpiperidin-2-yl)methyl]piperazine

C12H25N3 — CID 64951928

IUPAC3-methyl-1-[(1-methylpiperidin-2-yl)methyl]piperazine
SMILESCC1CN(CC2CCCCN2C)CCN1
InChIInChI=1S/C12H25N3/c1-11-9-15(8-6-13-11)10-12-5-3-4-7-14(12)2/h11-13H,3-10H2,1-2H3
InChIKeyZUEUWXGXIZDODE-UHFFFAOYSA-N
MW211.35 g/mol
LogP0.76
Rot. Bonds2

About 3-methyl-1-[(1-methylpiperidin-2-yl)methyl]piperazine

3-methyl-1-[(1-methylpiperidin-2-yl)methyl]piperazine (PubChem CID 64951928) has the molecular formula C12H25N3 and a molecular weight of 211.35 g/mol. Its IUPAC name is 3-methyl-1-[(1-methylpiperidin-2-yl)methyl]piperazine.

Molecular Properties

Compound Name3-methyl-1-[(1-methylpiperidin-2-yl)methyl]piperazine
PubChem CID64951928
Molecular FormulaC12H25N3
Molecular Weight211.35 g/mol
Exact Mass211.20
IUPAC Name3-methyl-1-[(1-methylpiperidin-2-yl)methyl]piperazine
SMILESCC1CN(CC2CCCCN2C)CCN1
InChIInChI=1S/C12H25N3/c1-11-9-15(8-6-13-11)10-12-5-3-4-7-14(12)2/h11-13H,3-10H2,1-2H3
InChIKeyZUEUWXGXIZDODE-UHFFFAOYSA-N
XLogP0.76
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.35
LogP ≤ 50.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[[(2R)-1-methylpiperidin-2-yl]methyl]piperazine
CID 51614709
(2S)-1-methyl-2-(pyrrolidin-1-ylmethyl)pyrrolidine
CID 10920923
(3R)-1-(cyclobutylmethyl)-3-methylpiperazine
CID 104975501
1-[(1-ethylpiperidin-2-yl)methyl]-3-methyl-1,4-diazepane
CID 115102113
3-methyl-1-(2-pyrrolidin-1-ylethyl)piperazine
CID 65448835
[(2S,4S)-2-methylpiperidin-4-yl]-[4-[(1-methylpiperidin-2-yl)methyl]piperazin-1-yl]methanone
CID 120636089
3-methyl-1-[(1-methylpiperidin-2-yl)methyl]piperazin-2-one
CID 115101940
3-methyl-1-[(2,2,3,3-tetramethylcyclopropyl)methyl]piperazine
CID 79351237
1-[(1-methylpyrrolidin-2-yl)methyl]piperidin-3-amine
CID 106021248
(3S)-1-[(1-methylpyrrolidin-2-yl)methyl]piperidin-3-ol
CID 127014895
(2R)-2-ethyl-1-methylpiperidine
CID 67552955
1-methyl-2-[(1-methylpiperidin-2-yl)methyl]piperidine
CID 54394556

Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-[(1-methylpiperidin-2-yl)methyl]piperazine?
The IUPAC name of 3-methyl-1-[(1-methylpiperidin-2-yl)methyl]piperazine (CID 64951928) is 3-methyl-1-[(1-methylpiperidin-2-yl)methyl]piperazine.
What is the SMILES notation for 3-methyl-1-[(1-methylpiperidin-2-yl)methyl]piperazine?
The canonical SMILES for 3-methyl-1-[(1-methylpiperidin-2-yl)methyl]piperazine is CC1CN(CC2CCCCN2C)CCN1.
What is the InChIKey of 3-methyl-1-[(1-methylpiperidin-2-yl)methyl]piperazine?
The InChIKey is ZUEUWXGXIZDODE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3/c1-11-9-15(8-6-13-11)10-12-5-3-4-7-14(12)2/h11-13H,3-10H2,1-2H3.
What are the key properties of 3-methyl-1-[(1-methylpiperidin-2-yl)methyl]piperazine?
3-methyl-1-[(1-methylpiperidin-2-yl)methyl]piperazine has a molecular weight of 211.35 g/mol, XLogP of 0.76, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-[(1-methylpiperidin-2-yl)methyl]piperazine is sourced from PubChem (CID 64951928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).