3,4-dimethyl-1-(pyrrolidin-3-ylmethyl)pyrrolidine

C11H22N2 — CID 79188343

IUPAC3,4-dimethyl-1-(pyrrolidin-3-ylmethyl)pyrrolidine
SMILESCC1CN(CC2CCNC2)CC1C
InChIInChI=1S/C11H22N2/c1-9-6-13(7-10(9)2)8-11-3-4-12-5-11/h9-12H,3-8H2,1-2H3
InChIKeyAPGQALOMDHLAIV-UHFFFAOYSA-N
MW182.31 g/mol
LogP1.18
Rot. Bonds2

About 3,4-dimethyl-1-(pyrrolidin-3-ylmethyl)pyrrolidine

3,4-dimethyl-1-(pyrrolidin-3-ylmethyl)pyrrolidine (PubChem CID 79188343) has the molecular formula C11H22N2 and a molecular weight of 182.31 g/mol. Its IUPAC name is 3,4-dimethyl-1-(pyrrolidin-3-ylmethyl)pyrrolidine.

Molecular Properties

Compound Name3,4-dimethyl-1-(pyrrolidin-3-ylmethyl)pyrrolidine
PubChem CID79188343
Molecular FormulaC11H22N2
Molecular Weight182.31 g/mol
Exact Mass182.18
IUPAC Name3,4-dimethyl-1-(pyrrolidin-3-ylmethyl)pyrrolidine
SMILESCC1CN(CC2CCNC2)CC1C
InChIInChI=1S/C11H22N2/c1-9-6-13(7-10(9)2)8-11-3-4-12-5-11/h9-12H,3-8H2,1-2H3
InChIKeyAPGQALOMDHLAIV-UHFFFAOYSA-N
XLogP1.18
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.31
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[(3,4-dimethylpyrrolidin-1-yl)methyl]piperidine
CID 79187862
(3S)-3-methyl-1-[[(3R)-pyrrolidin-3-yl]methyl]piperidine
CID 86323532
1-[[(3R)-pyrrolidin-3-yl]methyl]pyrrolidine
CID 58880458
1-methyl-4-(pyrrolidin-3-ylmethyl)piperazine
CID 14627372
4-[(3,4-dimethylpyrrolidin-1-yl)methyl]-2-methylpiperidine
CID 106741132
1-[[(3R)-pyrrolidin-3-yl]methyl]piperidine
CID 86311653
ethane;4-ethyl-1-(pyrrolidin-3-ylmethyl)piperidine
CID 166478727
3-methyl-1-(piperidin-3-ylmethyl)piperidin-4-ol;hydrochloride
CID 120848616
1,2,6-trimethyl-4-(piperidin-4-ylmethyl)piperazine
CID 114538087
1-[[(3R)-pyrrolidin-3-yl]methyl]piperidin-4-ol
CID 86323550
2,6-dimethyl-4-(piperidin-4-ylmethyl)morpholine
CID 16767739
3-[(3,3-dimethoxyazetidin-1-yl)methyl]pyrrolidine
CID 80563875

Frequently Asked Questions

What is the IUPAC name of 3,4-dimethyl-1-(pyrrolidin-3-ylmethyl)pyrrolidine?
The IUPAC name of 3,4-dimethyl-1-(pyrrolidin-3-ylmethyl)pyrrolidine (CID 79188343) is 3,4-dimethyl-1-(pyrrolidin-3-ylmethyl)pyrrolidine.
What is the SMILES notation for 3,4-dimethyl-1-(pyrrolidin-3-ylmethyl)pyrrolidine?
The canonical SMILES for 3,4-dimethyl-1-(pyrrolidin-3-ylmethyl)pyrrolidine is CC1CN(CC2CCNC2)CC1C.
What is the InChIKey of 3,4-dimethyl-1-(pyrrolidin-3-ylmethyl)pyrrolidine?
The InChIKey is APGQALOMDHLAIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2/c1-9-6-13(7-10(9)2)8-11-3-4-12-5-11/h9-12H,3-8H2,1-2H3.
What are the key properties of 3,4-dimethyl-1-(pyrrolidin-3-ylmethyl)pyrrolidine?
3,4-dimethyl-1-(pyrrolidin-3-ylmethyl)pyrrolidine has a molecular weight of 182.31 g/mol, XLogP of 1.18, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dimethyl-1-(pyrrolidin-3-ylmethyl)pyrrolidine is sourced from PubChem (CID 79188343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).