1-(4,4-dimethylpiperidin-3-yl)-4-methylpiperazine

C12H25N3 — CID 117025957

IUPAC1-(4,4-dimethylpiperidin-3-yl)-4-methylpiperazine
SMILESCN1CCN(C2CNCCC2(C)C)CC1
InChIInChI=1S/C12H25N3/c1-12(2)4-5-13-10-11(12)15-8-6-14(3)7-9-15/h11,13H,4-10H2,1-3H3
InChIKeyMQISCAYNCXIAMJ-UHFFFAOYSA-N
MW211.35 g/mol
LogP0.62
Rot. Bonds1

About 1-(4,4-dimethylpiperidin-3-yl)-4-methylpiperazine

1-(4,4-dimethylpiperidin-3-yl)-4-methylpiperazine (PubChem CID 117025957) has the molecular formula C12H25N3 and a molecular weight of 211.35 g/mol. Its IUPAC name is 1-(4,4-dimethylpiperidin-3-yl)-4-methylpiperazine.

Molecular Properties

Compound Name1-(4,4-dimethylpiperidin-3-yl)-4-methylpiperazine
PubChem CID117025957
Molecular FormulaC12H25N3
Molecular Weight211.35 g/mol
Exact Mass211.20
IUPAC Name1-(4,4-dimethylpiperidin-3-yl)-4-methylpiperazine
SMILESCN1CCN(C2CNCCC2(C)C)CC1
InChIInChI=1S/C12H25N3/c1-12(2)4-5-13-10-11(12)15-8-6-14(3)7-9-15/h11,13H,4-10H2,1-3H3
InChIKeyMQISCAYNCXIAMJ-UHFFFAOYSA-N
XLogP0.62
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.35
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(3,3-dimethylazetidin-1-yl)-4-methylpiperidin-4-ol
CID 130746790
1-(azetidin-3-yl)-4-methylpiperazine
CID 20659800
4-(4,4-dimethylpyrrolidin-3-yl)morpholine
CID 91666792
1-methyl-4-pyrrolidin-3-yl-1,4-diazepane
CID 23282605
1,4-dimethylpiperazine;ethane
CID 91292414
2-methyl-1,3,4,6,7,8,9,9a-octahydropyrazino[1,2-a]pyrazine;dihydrochloride
CID 155822363
1-(3,3-difluoro-1-methylpiperidin-4-yl)-4-methylpiperazine;ethane
CID 170578014
1-methyl-4-piperidin-4-ylpiperazine;hydrochloride
CID 45074780
1-(3,5-dimethylpiperidin-4-yl)-4-methylpiperazine
CID 165468848
1-(1-cyclopropyl-4,4-dimethylpiperidin-3-yl)piperazine
CID 117025945
1-(2,2-dimethylcyclohexyl)-6-methyl-1,4-diazepane
CID 79879039
2-[4-(3,3-dimethylpiperidin-4-yl)piperazin-1-yl]ethanol
CID 114235692

Frequently Asked Questions

What is the IUPAC name of 1-(4,4-dimethylpiperidin-3-yl)-4-methylpiperazine?
The IUPAC name of 1-(4,4-dimethylpiperidin-3-yl)-4-methylpiperazine (CID 117025957) is 1-(4,4-dimethylpiperidin-3-yl)-4-methylpiperazine.
What is the SMILES notation for 1-(4,4-dimethylpiperidin-3-yl)-4-methylpiperazine?
The canonical SMILES for 1-(4,4-dimethylpiperidin-3-yl)-4-methylpiperazine is CN1CCN(C2CNCCC2(C)C)CC1.
What is the InChIKey of 1-(4,4-dimethylpiperidin-3-yl)-4-methylpiperazine?
The InChIKey is MQISCAYNCXIAMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3/c1-12(2)4-5-13-10-11(12)15-8-6-14(3)7-9-15/h11,13H,4-10H2,1-3H3.
What are the key properties of 1-(4,4-dimethylpiperidin-3-yl)-4-methylpiperazine?
1-(4,4-dimethylpiperidin-3-yl)-4-methylpiperazine has a molecular weight of 211.35 g/mol, XLogP of 0.62, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4,4-dimethylpiperidin-3-yl)-4-methylpiperazine is sourced from PubChem (CID 117025957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).