4-ethyl-3-methyl-2-(3-methylpyrrolidin-1-yl)pyridine;methane

C14H24N2 — CID 170581317

IUPAC4-ethyl-3-methyl-2-(3-methylpyrrolidin-1-yl)pyridine;methane
SMILESC.CCc1ccnc(N2CCC(C)C2)c1C
InChIInChI=1S/C13H20N2.CH4/c1-4-12-5-7-14-13(11(12)3)15-8-6-10(2)9-15;/h5,7,10H,4,6,8-9H2,1-3H3;1H4
InChIKeyDKFGFDATYFAAQF-UHFFFAOYSA-N
MW220.36 g/mol
LogP3.43
Rot. Bonds2

About 4-ethyl-3-methyl-2-(3-methylpyrrolidin-1-yl)pyridine;methane

4-ethyl-3-methyl-2-(3-methylpyrrolidin-1-yl)pyridine;methane (PubChem CID 170581317) has the molecular formula C14H24N2 and a molecular weight of 220.36 g/mol. Its IUPAC name is 4-ethyl-3-methyl-2-(3-methylpyrrolidin-1-yl)pyridine;methane.

Molecular Properties

Compound Name4-ethyl-3-methyl-2-(3-methylpyrrolidin-1-yl)pyridine;methane
PubChem CID170581317
Molecular FormulaC14H24N2
Molecular Weight220.36 g/mol
Exact Mass220.19
IUPAC Name4-ethyl-3-methyl-2-(3-methylpyrrolidin-1-yl)pyridine;methane
SMILESC.CCc1ccnc(N2CCC(C)C2)c1C
InChIInChI=1S/C13H20N2.CH4/c1-4-12-5-7-14-13(11(12)3)15-8-6-10(2)9-15;/h5,7,10H,4,6,8-9H2,1-3H3;1H4
InChIKeyDKFGFDATYFAAQF-UHFFFAOYSA-N
XLogP3.43
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 53.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-3-methyl-2-(3-methylpyrrolidin-1-yl)pyridine;methane?
The IUPAC name of 4-ethyl-3-methyl-2-(3-methylpyrrolidin-1-yl)pyridine;methane (CID 170581317) is 4-ethyl-3-methyl-2-(3-methylpyrrolidin-1-yl)pyridine;methane.
What is the SMILES notation for 4-ethyl-3-methyl-2-(3-methylpyrrolidin-1-yl)pyridine;methane?
The canonical SMILES for 4-ethyl-3-methyl-2-(3-methylpyrrolidin-1-yl)pyridine;methane is C.CCc1ccnc(N2CCC(C)C2)c1C.
What is the InChIKey of 4-ethyl-3-methyl-2-(3-methylpyrrolidin-1-yl)pyridine;methane?
The InChIKey is DKFGFDATYFAAQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2.CH4/c1-4-12-5-7-14-13(11(12)3)15-8-6-10(2)9-15;/h5,7,10H,4,6,8-9H2,1-3H3;1H4.
What are the key properties of 4-ethyl-3-methyl-2-(3-methylpyrrolidin-1-yl)pyridine;methane?
4-ethyl-3-methyl-2-(3-methylpyrrolidin-1-yl)pyridine;methane has a molecular weight of 220.36 g/mol, XLogP of 3.43, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-3-methyl-2-(3-methylpyrrolidin-1-yl)pyridine;methane is sourced from PubChem (CID 170581317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).