1-methanidyl-4-piperidin-1-ylpiperidine

C11H21N2- — CID 20723188

IUPAC1-methanidyl-4-piperidin-1-ylpiperidine
SMILES[CH2-]N1CCC(N2CCCCC2)CC1
InChIInChI=1S/C11H21N2/c1-12-9-5-11(6-10-12)13-7-3-2-4-8-13/h11H,1-10H2/q-1
InChIKeyFMSRUZRKOUWFOZ-UHFFFAOYSA-N
MW181.30 g/mol
LogP1.73
Rot. Bonds1

About 1-methanidyl-4-piperidin-1-ylpiperidine

1-methanidyl-4-piperidin-1-ylpiperidine (PubChem CID 20723188) has the molecular formula C11H21N2- and a molecular weight of 181.30 g/mol. Its IUPAC name is 1-methanidyl-4-piperidin-1-ylpiperidine.

Molecular Properties

Compound Name1-methanidyl-4-piperidin-1-ylpiperidine
PubChem CID20723188
Molecular FormulaC11H21N2-
Molecular Weight181.30 g/mol
Exact Mass181.17
IUPAC Name1-methanidyl-4-piperidin-1-ylpiperidine
SMILES[CH2-]N1CCC(N2CCCCC2)CC1
InChIInChI=1S/C11H21N2/c1-12-9-5-11(6-10-12)13-7-3-2-4-8-13/h11H,1-10H2/q-1
InChIKeyFMSRUZRKOUWFOZ-UHFFFAOYSA-N
XLogP1.73
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.30
LogP ≤ 51.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

1,4'-Bipiperidine
CID 78607
1,2-Dipiperidinoethane
CID 74733
1,3-Dipiperidinopropane
CID 455456
6-Azoniaspiro(5.5)undecane, bromide (1:1)
CID 22706
1,4-Dipiperidino-2-butyne
CID 101344
N-cyclohexyl-1-ethyl-N-methyl-4-piperidinamine
CID 783843
1-(1-Methylpiperidin-4-yl)piperidin-4-amine
CID 22964505
(2R)-1-methyl-2-(2-piperidin-1-ylethyl)piperidine
CID 3246106
Di-beta-(piperidinoethyl)selenide
CID 134318
1-Methyl-2-[2-(1-piperidinyl)ethyl]piperidine
CID 410260
1,5-Di(1-piperidinyl)pentane
CID 240409
Piperidine, 1,1'-(1,3-propanediyl)bis-, dihydrochloride
CID 3047251

Frequently Asked Questions

What is the IUPAC name of 1-methanidyl-4-piperidin-1-ylpiperidine?
The IUPAC name of 1-methanidyl-4-piperidin-1-ylpiperidine (CID 20723188) is 1-methanidyl-4-piperidin-1-ylpiperidine.
What is the SMILES notation for 1-methanidyl-4-piperidin-1-ylpiperidine?
The canonical SMILES for 1-methanidyl-4-piperidin-1-ylpiperidine is [CH2-]N1CCC(N2CCCCC2)CC1.
What is the InChIKey of 1-methanidyl-4-piperidin-1-ylpiperidine?
The InChIKey is FMSRUZRKOUWFOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N2/c1-12-9-5-11(6-10-12)13-7-3-2-4-8-13/h11H,1-10H2/q-1.
What are the key properties of 1-methanidyl-4-piperidin-1-ylpiperidine?
1-methanidyl-4-piperidin-1-ylpiperidine has a molecular weight of 181.30 g/mol, XLogP of 1.73, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methanidyl-4-piperidin-1-ylpiperidine is sourced from PubChem (CID 20723188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).