1-methyl-4-[2-(2-methylpyrrolidin-2-yl)ethyl]piperidine

C13H26N2 — CID 117271418

IUPAC1-methyl-4-[2-(2-methylpyrrolidin-2-yl)ethyl]piperidine
SMILESCN1CCC(CCC2(C)CCCN2)CC1
InChIInChI=1S/C13H26N2/c1-13(7-3-9-14-13)8-4-12-5-10-15(2)11-6-12/h12,14H,3-11H2,1-2H3
InChIKeyNLWAJYVFEFTJBG-UHFFFAOYSA-N
MW210.36 g/mol
LogP2.25
Rot. Bonds3

About 1-methyl-4-[2-(2-methylpyrrolidin-2-yl)ethyl]piperidine

1-methyl-4-[2-(2-methylpyrrolidin-2-yl)ethyl]piperidine (PubChem CID 117271418) has the molecular formula C13H26N2 and a molecular weight of 210.36 g/mol. Its IUPAC name is 1-methyl-4-[2-(2-methylpyrrolidin-2-yl)ethyl]piperidine.

Molecular Properties

Compound Name1-methyl-4-[2-(2-methylpyrrolidin-2-yl)ethyl]piperidine
PubChem CID117271418
Molecular FormulaC13H26N2
Molecular Weight210.36 g/mol
Exact Mass210.21
IUPAC Name1-methyl-4-[2-(2-methylpyrrolidin-2-yl)ethyl]piperidine
SMILESCN1CCC(CCC2(C)CCCN2)CC1
InChIInChI=1S/C13H26N2/c1-13(7-3-9-14-13)8-4-12-5-10-15(2)11-6-12/h12,14H,3-11H2,1-2H3
InChIKeyNLWAJYVFEFTJBG-UHFFFAOYSA-N
XLogP2.25
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-2-[2-(1-methylpyrrolidin-3-yl)ethyl]piperidine
CID 117271582
1-methyl-3-[2-(2-methylpyrrolidin-2-yl)ethyl]piperidine
CID 117271478
4-[2-(2-ethylpyrrolidin-2-yl)ethyl]-1-methylpiperidine
CID 117271420
1-methyl-4-[2-(2-methylpyrrolidin-2-yl)ethyl]piperazine
CID 117271549
3-ethyl-3-methyl-1-[2-(1-methylpiperidin-4-yl)ethyl]-1,4-diazepane
CID 114516842
1-methyl-4-[2-(2-methylpiperidin-2-yl)ethyl]piperazine
CID 117271787
2-(3,3-dimethylbutyl)-2-methylpyrrolidine
CID 66466219
1-ethyl-3-[(2-methylpyrrolidin-2-yl)methyl]pyrrolidine
CID 117270951
[2-[(1-methylpyrrolidin-3-yl)methyl]pyrrolidin-2-yl]methanol
CID 115103176
2-methyl-2-[2-(thiolan-2-yl)ethyl]piperidine
CID 117271620
N-[(2-ethylpyrrolidin-2-yl)methyl]-N-methyl-1-(1-methylpiperidin-4-yl)methanamine
CID 83074027
methyl 2-[(1-methylpiperidin-4-yl)methyl]pyrrolidine-2-carboxylate
CID 115103207

Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-[2-(2-methylpyrrolidin-2-yl)ethyl]piperidine?
The IUPAC name of 1-methyl-4-[2-(2-methylpyrrolidin-2-yl)ethyl]piperidine (CID 117271418) is 1-methyl-4-[2-(2-methylpyrrolidin-2-yl)ethyl]piperidine.
What is the SMILES notation for 1-methyl-4-[2-(2-methylpyrrolidin-2-yl)ethyl]piperidine?
The canonical SMILES for 1-methyl-4-[2-(2-methylpyrrolidin-2-yl)ethyl]piperidine is CN1CCC(CCC2(C)CCCN2)CC1.
What is the InChIKey of 1-methyl-4-[2-(2-methylpyrrolidin-2-yl)ethyl]piperidine?
The InChIKey is NLWAJYVFEFTJBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2/c1-13(7-3-9-14-13)8-4-12-5-10-15(2)11-6-12/h12,14H,3-11H2,1-2H3.
What are the key properties of 1-methyl-4-[2-(2-methylpyrrolidin-2-yl)ethyl]piperidine?
1-methyl-4-[2-(2-methylpyrrolidin-2-yl)ethyl]piperidine has a molecular weight of 210.36 g/mol, XLogP of 2.25, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-[2-(2-methylpyrrolidin-2-yl)ethyl]piperidine is sourced from PubChem (CID 117271418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).