3-(1-ethyl-2-methylpyrrolidin-2-yl)pyridine

C12H18N2 — CID 176918775

IUPAC3-(1-ethyl-2-methylpyrrolidin-2-yl)pyridine
SMILESCCN1CCCC1(C)c1cccnc1
InChIInChI=1S/C12H18N2/c1-3-14-9-5-7-12(14,2)11-6-4-8-13-10-11/h4,6,8,10H,3,5,7,9H2,1-2H3
InChIKeyKNDGPTCIFGKCQY-UHFFFAOYSA-N
MW190.29 g/mol
LogP2.41
Rot. Bonds2

About 3-(1-ethyl-2-methylpyrrolidin-2-yl)pyridine

3-(1-ethyl-2-methylpyrrolidin-2-yl)pyridine (PubChem CID 176918775) has the molecular formula C12H18N2 and a molecular weight of 190.29 g/mol. Its IUPAC name is 3-(1-ethyl-2-methylpyrrolidin-2-yl)pyridine.

Molecular Properties

Compound Name3-(1-ethyl-2-methylpyrrolidin-2-yl)pyridine
PubChem CID176918775
Molecular FormulaC12H18N2
Molecular Weight190.29 g/mol
Exact Mass190.15
IUPAC Name3-(1-ethyl-2-methylpyrrolidin-2-yl)pyridine
SMILESCCN1CCCC1(C)c1cccnc1
InChIInChI=1S/C12H18N2/c1-3-14-9-5-7-12(14,2)11-6-4-8-13-10-11/h4,6,8,10H,3,5,7,9H2,1-2H3
InChIKeyKNDGPTCIFGKCQY-UHFFFAOYSA-N
XLogP2.41
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 52.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-methyl-4-[3-(2-methyl-2-pyridin-3-ylpyrrolidin-1-yl)propyl]piperazine
CID 176918774
ethane;3-(1-methylcyclobutyl)pyridine
CID 142353863
1,6-diethyl-1,6-diazaspiro[4.4]nonane
CID 89371000
1-benzyl-2-pyridin-3-ylpyrrolidine-2-carbonitrile
CID 90115436
N-[(2-pyridin-3-ylspiro[3.3]heptan-2-yl)methyl]ethanamine
CID 80522715
1-methyl-4-pyridin-3-ylpiperidin-4-ol
CID 4172974
(7aS)-2-(4-hydroxy-4-pyridin-3-ylcyclohexyl)-7a-methyl-6,7-dihydro-5H-pyrrolo[1,2-c]imidazole-1,3-dione
CID 167748962
3-[2-[(4-fluorophenyl)methyl]-1-methylpyrrolidin-2-yl]pyridine
CID 67821251
1-methyl-2-pyridin-3-ylpyrrolidine-2-carboxamide
CID 56964987
3-(2-propylpyrrolidin-2-yl)pyridine
CID 66468075
2-methyl-4-oxo-2-pyridin-3-ylazetidine-1-sulfonyl chloride
CID 64665752
3-(1-fluorocyclobutyl)pyridine
CID 158766896

Frequently Asked Questions

What is the IUPAC name of 3-(1-ethyl-2-methylpyrrolidin-2-yl)pyridine?
The IUPAC name of 3-(1-ethyl-2-methylpyrrolidin-2-yl)pyridine (CID 176918775) is 3-(1-ethyl-2-methylpyrrolidin-2-yl)pyridine.
What is the SMILES notation for 3-(1-ethyl-2-methylpyrrolidin-2-yl)pyridine?
The canonical SMILES for 3-(1-ethyl-2-methylpyrrolidin-2-yl)pyridine is CCN1CCCC1(C)c1cccnc1.
What is the InChIKey of 3-(1-ethyl-2-methylpyrrolidin-2-yl)pyridine?
The InChIKey is KNDGPTCIFGKCQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2/c1-3-14-9-5-7-12(14,2)11-6-4-8-13-10-11/h4,6,8,10H,3,5,7,9H2,1-2H3.
What are the key properties of 3-(1-ethyl-2-methylpyrrolidin-2-yl)pyridine?
3-(1-ethyl-2-methylpyrrolidin-2-yl)pyridine has a molecular weight of 190.29 g/mol, XLogP of 2.41, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-ethyl-2-methylpyrrolidin-2-yl)pyridine is sourced from PubChem (CID 176918775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).