5-ethyl-2-(pyrrolidin-1-ylmethyl)pyridine

C12H18N2 — CID 89095451

IUPAC5-ethyl-2-(pyrrolidin-1-ylmethyl)pyridine
SMILESCCc1ccc(CN2CCCC2)nc1
InChIInChI=1S/C12H18N2/c1-2-11-5-6-12(13-9-11)10-14-7-3-4-8-14/h5-6,9H,2-4,7-8,10H2,1H3
InChIKeyZQGXQUXAHHBYQV-UHFFFAOYSA-N
MW190.29 g/mol
LogP2.24
Rot. Bonds3

About 5-ethyl-2-(pyrrolidin-1-ylmethyl)pyridine

5-ethyl-2-(pyrrolidin-1-ylmethyl)pyridine (PubChem CID 89095451) has the molecular formula C12H18N2 and a molecular weight of 190.29 g/mol. Its IUPAC name is 5-ethyl-2-(pyrrolidin-1-ylmethyl)pyridine.

Molecular Properties

Compound Name5-ethyl-2-(pyrrolidin-1-ylmethyl)pyridine
PubChem CID89095451
Molecular FormulaC12H18N2
Molecular Weight190.29 g/mol
Exact Mass190.15
IUPAC Name5-ethyl-2-(pyrrolidin-1-ylmethyl)pyridine
SMILESCCc1ccc(CN2CCCC2)nc1
InChIInChI=1S/C12H18N2/c1-2-11-5-6-12(13-9-11)10-14-7-3-4-8-14/h5-6,9H,2-4,7-8,10H2,1H3
InChIKeyZQGXQUXAHHBYQV-UHFFFAOYSA-N
XLogP2.24
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-ethyl-2-(piperidin-1-ylmethyl)pyridine
CID 58495459
1-[(5-ethyl-2-pyridinyl)methyl]-4-methylpiperazine
CID 118638744
1-[(5-ethyl-2-pyridinyl)methyl]-4-(2-methylsulfanylethyl)piperazine
CID 77096922
(3S)-3-[(dimethylamino)methyl]-1-[(5-ethyl-2-pyridinyl)methyl]piperidin-3-ol
CID 95882427
4-[[1-[(5-ethyl-2-pyridinyl)methyl]piperidin-4-yl]methyl]morpholine
CID 77091868
[1-[(5-ethyl-2-pyridinyl)methyl]pyrrolidin-3-yl]methanamine
CID 79739861
(3R,4R)-1-[(5-ethyl-2-pyridinyl)methyl]-4-fluoropyrrolidin-3-ol
CID 131891791
[(3S)-1-[(5-ethyl-2-pyridinyl)methyl]piperidin-3-yl]-pyridin-2-ylmethanone
CID 99926517
4-[1-[(5-ethyl-2-pyridinyl)methyl]piperidin-3-yl]benzoic acid
CID 72938414
6-(azocan-1-ylmethyl)pyridin-3-ol
CID 82977011
[5-(azetidin-1-ylmethyl)-2-pyridinyl]methanamine
CID 105437200
1-[4-[(5-ethyl-2-pyridinyl)methyl]piperazin-1-yl]isoquinoline
CID 50950975

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-2-(pyrrolidin-1-ylmethyl)pyridine?
The IUPAC name of 5-ethyl-2-(pyrrolidin-1-ylmethyl)pyridine (CID 89095451) is 5-ethyl-2-(pyrrolidin-1-ylmethyl)pyridine.
What is the SMILES notation for 5-ethyl-2-(pyrrolidin-1-ylmethyl)pyridine?
The canonical SMILES for 5-ethyl-2-(pyrrolidin-1-ylmethyl)pyridine is CCc1ccc(CN2CCCC2)nc1.
What is the InChIKey of 5-ethyl-2-(pyrrolidin-1-ylmethyl)pyridine?
The InChIKey is ZQGXQUXAHHBYQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2/c1-2-11-5-6-12(13-9-11)10-14-7-3-4-8-14/h5-6,9H,2-4,7-8,10H2,1H3.
What are the key properties of 5-ethyl-2-(pyrrolidin-1-ylmethyl)pyridine?
5-ethyl-2-(pyrrolidin-1-ylmethyl)pyridine has a molecular weight of 190.29 g/mol, XLogP of 2.24, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-2-(pyrrolidin-1-ylmethyl)pyridine is sourced from PubChem (CID 89095451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).