3-(3,4-dimethylpyrrolidin-1-yl)-5-methylpiperidine

C12H24N2 — CID 115373534

IUPAC3-(3,4-dimethylpyrrolidin-1-yl)-5-methylpiperidine
SMILESCC1CNCC(N2CC(C)C(C)C2)C1
InChIInChI=1S/C12H24N2/c1-9-4-12(6-13-5-9)14-7-10(2)11(3)8-14/h9-13H,4-8H2,1-3H3
InChIKeyKBBAIMXSPJDULG-UHFFFAOYSA-N
MW196.34 g/mol
LogP1.57
Rot. Bonds1

About 3-(3,4-dimethylpyrrolidin-1-yl)-5-methylpiperidine

3-(3,4-dimethylpyrrolidin-1-yl)-5-methylpiperidine (PubChem CID 115373534) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is 3-(3,4-dimethylpyrrolidin-1-yl)-5-methylpiperidine.

Molecular Properties

Compound Name3-(3,4-dimethylpyrrolidin-1-yl)-5-methylpiperidine
PubChem CID115373534
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC Name3-(3,4-dimethylpyrrolidin-1-yl)-5-methylpiperidine
SMILESCC1CNCC(N2CC(C)C(C)C2)C1
InChIInChI=1S/C12H24N2/c1-9-4-12(6-13-5-9)14-7-10(2)11(3)8-14/h9-13H,4-8H2,1-3H3
InChIKeyKBBAIMXSPJDULG-UHFFFAOYSA-N
XLogP1.57
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(5-methylpiperidin-3-yl)-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole
CID 115560129
3-methyl-5-pyrrolidin-1-ylpiperidine
CID 79905165
3-methoxy-4-methyl-1-(5-methylpiperidin-3-yl)piperidine
CID 102965792
1-(5-methylpiperidin-3-yl)-4-propylpiperidine
CID 115373476
azane;3,5-dimethylpiperidine
CID 23174858
(3S,5R)-1-(azetidin-3-yl)-5-methylpiperidin-3-ol
CID 130802727
3-(4-ethoxypiperidin-1-yl)-5-methylpiperidine
CID 115373405
3-methyl-5-(3-phenylpyrrolidin-1-yl)piperidine
CID 115373475
tert-butyl (3S,5S)-5-[(3S,5R)-3,5-dimethylpiperidin-1-yl]piperidine-3-carboxylate
CID 125458007
(3S,5R)-3-methyl-5-pyrazol-1-ylpiperidine
CID 146329669
2-methyl-1-(5-methylpiperidin-3-yl)azepane
CID 115373516
3,7-dimethyl-1-(3,3,5,5-tetramethylcyclohexyl)-1,5-diazocane
CID 103968293

Frequently Asked Questions

What is the IUPAC name of 3-(3,4-dimethylpyrrolidin-1-yl)-5-methylpiperidine?
The IUPAC name of 3-(3,4-dimethylpyrrolidin-1-yl)-5-methylpiperidine (CID 115373534) is 3-(3,4-dimethylpyrrolidin-1-yl)-5-methylpiperidine.
What is the SMILES notation for 3-(3,4-dimethylpyrrolidin-1-yl)-5-methylpiperidine?
The canonical SMILES for 3-(3,4-dimethylpyrrolidin-1-yl)-5-methylpiperidine is CC1CNCC(N2CC(C)C(C)C2)C1.
What is the InChIKey of 3-(3,4-dimethylpyrrolidin-1-yl)-5-methylpiperidine?
The InChIKey is KBBAIMXSPJDULG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2/c1-9-4-12(6-13-5-9)14-7-10(2)11(3)8-14/h9-13H,4-8H2,1-3H3.
What are the key properties of 3-(3,4-dimethylpyrrolidin-1-yl)-5-methylpiperidine?
3-(3,4-dimethylpyrrolidin-1-yl)-5-methylpiperidine has a molecular weight of 196.34 g/mol, XLogP of 1.57, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,4-dimethylpyrrolidin-1-yl)-5-methylpiperidine is sourced from PubChem (CID 115373534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).