4-[(3,4-dimethylpyrrolidin-1-yl)methyl]-2-methylpiperidine

C13H26N2 — CID 106741132

IUPAC4-[(3,4-dimethylpyrrolidin-1-yl)methyl]-2-methylpiperidine
SMILESCC1CC(CN2CC(C)C(C)C2)CCN1
InChIInChI=1S/C13H26N2/c1-10-7-15(8-11(10)2)9-13-4-5-14-12(3)6-13/h10-14H,4-9H2,1-3H3
InChIKeyVBXVUKZKLBGDIC-UHFFFAOYSA-N
MW210.36 g/mol
LogP1.96
Rot. Bonds2

About 4-[(3,4-dimethylpyrrolidin-1-yl)methyl]-2-methylpiperidine

4-[(3,4-dimethylpyrrolidin-1-yl)methyl]-2-methylpiperidine (PubChem CID 106741132) has the molecular formula C13H26N2 and a molecular weight of 210.36 g/mol. Its IUPAC name is 4-[(3,4-dimethylpyrrolidin-1-yl)methyl]-2-methylpiperidine.

Molecular Properties

Compound Name4-[(3,4-dimethylpyrrolidin-1-yl)methyl]-2-methylpiperidine
PubChem CID106741132
Molecular FormulaC13H26N2
Molecular Weight210.36 g/mol
Exact Mass210.21
IUPAC Name4-[(3,4-dimethylpyrrolidin-1-yl)methyl]-2-methylpiperidine
SMILESCC1CC(CN2CC(C)C(C)C2)CCN1
InChIInChI=1S/C13H26N2/c1-10-7-15(8-11(10)2)9-13-4-5-14-12(3)6-13/h10-14H,4-9H2,1-3H3
InChIKeyVBXVUKZKLBGDIC-UHFFFAOYSA-N
XLogP1.96
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-4-[(3-propylpyrrolidin-1-yl)methyl]piperidine
CID 106741189
3,4-dimethyl-1-(pyrrolidin-3-ylmethyl)pyrrolidine
CID 79188343
2-ethyl-4-[(2-methylpiperidin-4-yl)methyl]thiomorpholine
CID 106741211
1-[(2-methylpiperidin-4-yl)methyl]-3-propoxypiperidine
CID 106740986
2-[(2-methylpiperidin-4-yl)methyl]-3,4-dihydro-1H-isoquinoline
CID 106740844
[(2R,4S)-2-methylpiperidin-4-yl]methanamine
CID 129409873
3-[(3,4-dimethylpyrrolidin-1-yl)methyl]piperidine
CID 79187862
2-[4-[(2-methylpiperidin-4-yl)methyl]piperazin-1-yl]pyrimidine
CID 106740839
2-[(2R)-2-methylpiperidin-4-yl]ethanol
CID 89139578
(2S)-2-[(3,4-dimethylpyrrolidin-1-yl)methyl]piperidine
CID 130522631
2-ethyl-4-methyl-1-[(2-methylpiperidin-4-yl)methyl]-1,4-diazepane
CID 114087202
1-cyclopropyl-N-[(2-methylpiperidin-4-yl)methyl]methanamine
CID 106740929

Frequently Asked Questions

What is the IUPAC name of 4-[(3,4-dimethylpyrrolidin-1-yl)methyl]-2-methylpiperidine?
The IUPAC name of 4-[(3,4-dimethylpyrrolidin-1-yl)methyl]-2-methylpiperidine (CID 106741132) is 4-[(3,4-dimethylpyrrolidin-1-yl)methyl]-2-methylpiperidine.
What is the SMILES notation for 4-[(3,4-dimethylpyrrolidin-1-yl)methyl]-2-methylpiperidine?
The canonical SMILES for 4-[(3,4-dimethylpyrrolidin-1-yl)methyl]-2-methylpiperidine is CC1CC(CN2CC(C)C(C)C2)CCN1.
What is the InChIKey of 4-[(3,4-dimethylpyrrolidin-1-yl)methyl]-2-methylpiperidine?
The InChIKey is VBXVUKZKLBGDIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2/c1-10-7-15(8-11(10)2)9-13-4-5-14-12(3)6-13/h10-14H,4-9H2,1-3H3.
What are the key properties of 4-[(3,4-dimethylpyrrolidin-1-yl)methyl]-2-methylpiperidine?
4-[(3,4-dimethylpyrrolidin-1-yl)methyl]-2-methylpiperidine has a molecular weight of 210.36 g/mol, XLogP of 1.96, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3,4-dimethylpyrrolidin-1-yl)methyl]-2-methylpiperidine is sourced from PubChem (CID 106741132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).