N,N-dimethyl-1-(2-piperidin-4-ylethyl)piperidin-3-amine;dihydrochloride

C14H31Cl2N3 — CID 120663622

IUPACN,N-dimethyl-1-(2-piperidin-4-ylethyl)piperidin-3-amine;dihydrochloride
SMILESCN(C)C1CCCN(CCC2CCNCC2)C1.Cl.Cl
InChIInChI=1S/C14H29N3.2ClH/c1-16(2)14-4-3-10-17(12-14)11-7-13-5-8-15-9-6-13;;/h13-15H,3-12H2,1-2H3;2*1H
InChIKeyOYOINKUWYGXOFG-UHFFFAOYSA-N
MW312.33 g/mol
LogP2.25
Rot. Bonds4

About N,N-dimethyl-1-(2-piperidin-4-ylethyl)piperidin-3-amine;dihydrochloride

N,N-dimethyl-1-(2-piperidin-4-ylethyl)piperidin-3-amine;dihydrochloride (PubChem CID 120663622) has the molecular formula C14H31Cl2N3 and a molecular weight of 312.33 g/mol. Its IUPAC name is N,N-dimethyl-1-(2-piperidin-4-ylethyl)piperidin-3-amine;dihydrochloride.

Molecular Properties

Compound NameN,N-dimethyl-1-(2-piperidin-4-ylethyl)piperidin-3-amine;dihydrochloride
PubChem CID120663622
Molecular FormulaC14H31Cl2N3
Molecular Weight312.33 g/mol
Exact Mass311.19
IUPAC NameN,N-dimethyl-1-(2-piperidin-4-ylethyl)piperidin-3-amine;dihydrochloride
SMILESCN(C)C1CCCN(CCC2CCNCC2)C1.Cl.Cl
InChIInChI=1S/C14H29N3.2ClH/c1-16(2)14-4-3-10-17(12-14)11-7-13-5-8-15-9-6-13;;/h13-15H,3-12H2,1-2H3;2*1H
InChIKeyOYOINKUWYGXOFG-UHFFFAOYSA-N
XLogP2.25
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.33
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-methyl-1-(2-piperidin-4-ylethyl)piperidine;dihydrochloride
CID 56831695
1-(2-piperidin-4-ylethyl)piperidin-3-ol
CID 83821198
1-[2-(1,3-dioxan-2-yl)ethyl]-N,N-dimethylpiperidin-3-amine
CID 66473733
(3R)-1-ethyl-N,N-dimethylpiperidin-3-amine
CID 95912118
N,N,4-trimethyl-1-(2-piperidin-4-ylethyl)pyrrolidin-3-amine
CID 81464634
N,1-dimethyl-N-(piperidin-4-ylmethyl)piperidin-3-amine
CID 62546416
N,N-dimethyl-1-(3-piperidin-3-ylbutyl)piperidin-3-amine
CID 81045799
3,5-dimethyl-1-(2-piperidin-4-ylethyl)piperidine;hydrochloride
CID 120663388
5-[3-(dimethylamino)piperidin-1-yl]-N'-hydroxy-2,2-dimethylpentanimidamide
CID 77109637
N-methyl-N-(1-methylpiperidin-3-yl)-2-piperidin-4-ylethanesulfonamide
CID 62546278
3,5-dimethyl-1-(2-piperidin-4-ylethyl)piperidine
CID 43149903
4,4-dimethyl-1-(2-piperidin-4-ylethyl)piperidine
CID 62937944

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-(2-piperidin-4-ylethyl)piperidin-3-amine;dihydrochloride?
The IUPAC name of N,N-dimethyl-1-(2-piperidin-4-ylethyl)piperidin-3-amine;dihydrochloride (CID 120663622) is N,N-dimethyl-1-(2-piperidin-4-ylethyl)piperidin-3-amine;dihydrochloride.
What is the SMILES notation for N,N-dimethyl-1-(2-piperidin-4-ylethyl)piperidin-3-amine;dihydrochloride?
The canonical SMILES for N,N-dimethyl-1-(2-piperidin-4-ylethyl)piperidin-3-amine;dihydrochloride is CN(C)C1CCCN(CCC2CCNCC2)C1.Cl.Cl.
What is the InChIKey of N,N-dimethyl-1-(2-piperidin-4-ylethyl)piperidin-3-amine;dihydrochloride?
The InChIKey is OYOINKUWYGXOFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3.2ClH/c1-16(2)14-4-3-10-17(12-14)11-7-13-5-8-15-9-6-13;;/h13-15H,3-12H2,1-2H3;2*1H.
What are the key properties of N,N-dimethyl-1-(2-piperidin-4-ylethyl)piperidin-3-amine;dihydrochloride?
N,N-dimethyl-1-(2-piperidin-4-ylethyl)piperidin-3-amine;dihydrochloride has a molecular weight of 312.33 g/mol, XLogP of 2.25, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-(2-piperidin-4-ylethyl)piperidin-3-amine;dihydrochloride is sourced from PubChem (CID 120663622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).