3-(1,3,3-trimethylpyrrolidin-2-yl)pyridine

C12H18N2 — CID 13292849

IUPAC3-(1,3,3-trimethylpyrrolidin-2-yl)pyridine
SMILESCN1CCC(C)(C)C1c1cccnc1
InChIInChI=1S/C12H18N2/c1-12(2)6-8-14(3)11(12)10-5-4-7-13-9-10/h4-5,7,9,11H,6,8H2,1-3H3
InChIKeyVTMRORHXACOVOE-UHFFFAOYSA-N
MW190.29 g/mol
LogP2.48
Rot. Bonds1

About 3-(1,3,3-trimethylpyrrolidin-2-yl)pyridine

3-(1,3,3-trimethylpyrrolidin-2-yl)pyridine (PubChem CID 13292849) has the molecular formula C12H18N2 and a molecular weight of 190.29 g/mol. Its IUPAC name is 3-(1,3,3-trimethylpyrrolidin-2-yl)pyridine.

Molecular Properties

Compound Name3-(1,3,3-trimethylpyrrolidin-2-yl)pyridine
PubChem CID13292849
Molecular FormulaC12H18N2
Molecular Weight190.29 g/mol
Exact Mass190.15
IUPAC Name3-(1,3,3-trimethylpyrrolidin-2-yl)pyridine
SMILESCN1CCC(C)(C)C1c1cccnc1
InChIInChI=1S/C12H18N2/c1-12(2)6-8-14(3)11(12)10-5-4-7-13-9-10/h4-5,7,9,11H,6,8H2,1-3H3
InChIKeyVTMRORHXACOVOE-UHFFFAOYSA-N
XLogP2.48
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 52.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

hydron;bis(3-(1-methylpyrrolidin-2-yl)pyridine)
CID 158783488
3-(1-methyl(115N)azolidin-2-yl)pyridine
CID 11126596
7-methyl-1,2-dipyridin-3-yl-2,7-diazaspiro[3.5]nonan-3-one
CID 59686108
CID 159245541
CID 159245541
ethane;3-(1-methylpyrrolidin-2-yl)pyridine
CID 144528341
3-(1-methylpyrrolidin-2-yl)pyridine;zinc
CID 67468212
methanol;3-[(2S)-1-methylpyrrolidin-2-yl]pyridine
CID 174330723
zinc;3-(1-methylpyrrolidin-2-yl)pyridine;oxygen(2-)
CID 157051312
[(2S)-1-methyl-2-pyridin-3-ylpyrrolidin-3-yl]methanol
CID 13292843
3-(1-methylpyrrolidin-2-yl)pyridine;propane
CID 91386217
N,N-dimethylmethanamine;3-[(2S)-1-methylpyrrolidin-2-yl]pyridine
CID 174560807
4,4-dimethyl-3-pyridin-3-ylcyclohexan-1-one
CID 165497054

Frequently Asked Questions

What is the IUPAC name of 3-(1,3,3-trimethylpyrrolidin-2-yl)pyridine?
The IUPAC name of 3-(1,3,3-trimethylpyrrolidin-2-yl)pyridine (CID 13292849) is 3-(1,3,3-trimethylpyrrolidin-2-yl)pyridine.
What is the SMILES notation for 3-(1,3,3-trimethylpyrrolidin-2-yl)pyridine?
The canonical SMILES for 3-(1,3,3-trimethylpyrrolidin-2-yl)pyridine is CN1CCC(C)(C)C1c1cccnc1.
What is the InChIKey of 3-(1,3,3-trimethylpyrrolidin-2-yl)pyridine?
The InChIKey is VTMRORHXACOVOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2/c1-12(2)6-8-14(3)11(12)10-5-4-7-13-9-10/h4-5,7,9,11H,6,8H2,1-3H3.
What are the key properties of 3-(1,3,3-trimethylpyrrolidin-2-yl)pyridine?
3-(1,3,3-trimethylpyrrolidin-2-yl)pyridine has a molecular weight of 190.29 g/mol, XLogP of 2.48, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1,3,3-trimethylpyrrolidin-2-yl)pyridine is sourced from PubChem (CID 13292849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).