1-methyl-4-(1-methylcycloheptyl)piperazine

C13H26N2 — CID 71065653

IUPAC1-methyl-4-(1-methylcycloheptyl)piperazine
SMILESCN1CCN(C2(C)CCCCCC2)CC1
InChIInChI=1S/C13H26N2/c1-13(7-5-3-4-6-8-13)15-11-9-14(2)10-12-15/h3-12H2,1-2H3
InChIKeyZDIGOGDHSCFENS-UHFFFAOYSA-N
MW210.36 g/mol
LogP2.35
Rot. Bonds1

About 1-methyl-4-(1-methylcycloheptyl)piperazine

1-methyl-4-(1-methylcycloheptyl)piperazine (PubChem CID 71065653) has the molecular formula C13H26N2 and a molecular weight of 210.36 g/mol. Its IUPAC name is 1-methyl-4-(1-methylcycloheptyl)piperazine.

Molecular Properties

Compound Name1-methyl-4-(1-methylcycloheptyl)piperazine
PubChem CID71065653
Molecular FormulaC13H26N2
Molecular Weight210.36 g/mol
Exact Mass210.21
IUPAC Name1-methyl-4-(1-methylcycloheptyl)piperazine
SMILESCN1CCN(C2(C)CCCCCC2)CC1
InChIInChI=1S/C13H26N2/c1-13(7-5-3-4-6-8-13)15-11-9-14(2)10-12-15/h3-12H2,1-2H3
InChIKeyZDIGOGDHSCFENS-UHFFFAOYSA-N
XLogP2.35
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 52.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(1-methylcyclooctyl)piperidin-4-ol
CID 67281005
1-methyl-4-(1-prop-1-ynylcyclohexyl)piperazine
CID 71150923
(1R)-1-[1-(4-methylpiperazin-1-yl)cyclohexyl]ethanol
CID 125470735
1-(1-methylcyclopentyl)piperidin-4-ol
CID 67281081
1,5,6-trimethyl-2-azatricyclo[4.3.3.22,5]tetradecane
CID 163797591
2-[1-(4-methylpiperazin-1-yl)cyclohexyl]ethanamine
CID 10846836
1-(1-methylcyclopentyl)-1,4-diazepane
CID 64686822
3-methyl-3-azaspiro[5.12]octadecane
CID 71021122
3-methyl-3-azaspiro[5.9]pentadecane
CID 170128255
1,6,6-trimethylazecane
CID 137411495
15,16-dichloro-4,11,15,16-tetramethyl-1,4,8,11-tetrazabicyclo[6.6.2]hexadecane
CID 141024509
1-(4-methyl-1,4-diazepan-1-yl)cyclohexane-1-carboxylic acid
CID 114994908

Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-(1-methylcycloheptyl)piperazine?
The IUPAC name of 1-methyl-4-(1-methylcycloheptyl)piperazine (CID 71065653) is 1-methyl-4-(1-methylcycloheptyl)piperazine.
What is the SMILES notation for 1-methyl-4-(1-methylcycloheptyl)piperazine?
The canonical SMILES for 1-methyl-4-(1-methylcycloheptyl)piperazine is CN1CCN(C2(C)CCCCCC2)CC1.
What is the InChIKey of 1-methyl-4-(1-methylcycloheptyl)piperazine?
The InChIKey is ZDIGOGDHSCFENS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2/c1-13(7-5-3-4-6-8-13)15-11-9-14(2)10-12-15/h3-12H2,1-2H3.
What are the key properties of 1-methyl-4-(1-methylcycloheptyl)piperazine?
1-methyl-4-(1-methylcycloheptyl)piperazine has a molecular weight of 210.36 g/mol, XLogP of 2.35, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-(1-methylcycloheptyl)piperazine is sourced from PubChem (CID 71065653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).