2,6-dimethyl-4-(pyrrolidin-3-ylmethyl)pyridine

C12H18N2 — CID 135135099

IUPAC2,6-dimethyl-4-(pyrrolidin-3-ylmethyl)pyridine
SMILESCc1cc(CC2CCNC2)cc(C)n1
InChIInChI=1S/C12H18N2/c1-9-5-12(6-10(2)14-9)7-11-3-4-13-8-11/h5-6,11,13H,3-4,7-8H2,1-2H3
InChIKeyJNCRDBNSWBWWNP-UHFFFAOYSA-N
MW190.29 g/mol
LogP1.85
Rot. Bonds2

About 2,6-dimethyl-4-(pyrrolidin-3-ylmethyl)pyridine

2,6-dimethyl-4-(pyrrolidin-3-ylmethyl)pyridine (PubChem CID 135135099) has the molecular formula C12H18N2 and a molecular weight of 190.29 g/mol. Its IUPAC name is 2,6-dimethyl-4-(pyrrolidin-3-ylmethyl)pyridine.

Molecular Properties

Compound Name2,6-dimethyl-4-(pyrrolidin-3-ylmethyl)pyridine
PubChem CID135135099
Molecular FormulaC12H18N2
Molecular Weight190.29 g/mol
Exact Mass190.15
IUPAC Name2,6-dimethyl-4-(pyrrolidin-3-ylmethyl)pyridine
SMILESCc1cc(CC2CCNC2)cc(C)n1
InChIInChI=1S/C12H18N2/c1-9-5-12(6-10(2)14-9)7-11-3-4-13-8-11/h5-6,11,13H,3-4,7-8H2,1-2H3
InChIKeyJNCRDBNSWBWWNP-UHFFFAOYSA-N
XLogP1.85
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[(2,6-dimethyl-4-pyridinyl)methyl]piperidin-4-ol
CID 146286067
4-methyl-6-(pyrrolidin-3-ylmethyl)pyrimidin-2-amine
CID 83858474
2-methyl-4-(piperidin-3-ylmethyl)-6-(trifluoromethyl)pyridine
CID 146284962
3-[(3-methylphenyl)methyl]pyrrolidine
CID 55252909
4,6-dimethyl-2-[[(3R)-pyrrolidin-3-yl]methoxy]pyrimidine
CID 94408418
2-methyl-6-(pyrrolidin-3-ylmethyl)pyrazine
CID 135135525
2-bromo-6-methyl-4-(pyrrolidin-3-ylmethyl)phenol
CID 84808877
3-[(3,5-dimethyl-4-nitrophenyl)methyl]pyrrolidine
CID 84797001
2-methyl-4-[[(3R)-piperidin-3-yl]methyl]pyridine
CID 139490801
3-[(3-bromo-4-fluoro-5-methylphenyl)methyl]pyrrolidine
CID 84809637
2-methyl-6-(pyrrolidin-3-ylmethyl)-1,3-benzothiazole
CID 84795648
2-methyl-5-[[(3S)-pyrrolidin-3-yl]methyl]pyrazine
CID 157065422

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-4-(pyrrolidin-3-ylmethyl)pyridine?
The IUPAC name of 2,6-dimethyl-4-(pyrrolidin-3-ylmethyl)pyridine (CID 135135099) is 2,6-dimethyl-4-(pyrrolidin-3-ylmethyl)pyridine.
What is the SMILES notation for 2,6-dimethyl-4-(pyrrolidin-3-ylmethyl)pyridine?
The canonical SMILES for 2,6-dimethyl-4-(pyrrolidin-3-ylmethyl)pyridine is Cc1cc(CC2CCNC2)cc(C)n1.
What is the InChIKey of 2,6-dimethyl-4-(pyrrolidin-3-ylmethyl)pyridine?
The InChIKey is JNCRDBNSWBWWNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2/c1-9-5-12(6-10(2)14-9)7-11-3-4-13-8-11/h5-6,11,13H,3-4,7-8H2,1-2H3.
What are the key properties of 2,6-dimethyl-4-(pyrrolidin-3-ylmethyl)pyridine?
2,6-dimethyl-4-(pyrrolidin-3-ylmethyl)pyridine has a molecular weight of 190.29 g/mol, XLogP of 1.85, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-4-(pyrrolidin-3-ylmethyl)pyridine is sourced from PubChem (CID 135135099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).