2-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]-5-methylpyridine

C14H22N2O — CID 110269242

IUPAC2-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]-5-methylpyridine
SMILESCOCCN1CCC(Cc2ccc(C)cn2)C1
InChIInChI=1S/C14H22N2O/c1-12-3-4-14(15-10-12)9-13-5-6-16(11-13)7-8-17-2/h3-4,10,13H,5-9,11H2,1-2H3
InChIKeyMYHSIINILPTVAP-UHFFFAOYSA-N
MW234.34 g/mol
LogP1.90
Rot. Bonds5

About 2-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]-5-methylpyridine

2-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]-5-methylpyridine (PubChem CID 110269242) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is 2-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]-5-methylpyridine.

Molecular Properties

Compound Name2-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]-5-methylpyridine
PubChem CID110269242
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name2-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]-5-methylpyridine
SMILESCOCCN1CCC(Cc2ccc(C)cn2)C1
InChIInChI=1S/C14H22N2O/c1-12-3-4-14(15-10-12)9-13-5-6-16(11-13)7-8-17-2/h3-4,10,13H,5-9,11H2,1-2H3
InChIKeyMYHSIINILPTVAP-UHFFFAOYSA-N
XLogP1.90
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 51.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-methyl-2-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyridine
CID 122607446
4-[5-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]pyrazin-2-yl]benzoic acid
CID 110120427
2-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]-1-methylimidazole
CID 110269241
1-(2-methoxyethyl)-4-[3-[(5-methyl-2-pyridinyl)oxy]propyl]piperazine
CID 135172513
N-methyl-1-[1-[(5-methyl-2-pyridinyl)methyl]pyrrolidin-3-yl]methanamine
CID 81319065
(4-methylphenyl)-[3-[(5-methyl-2-pyridinyl)methyl]pyrrolidin-1-yl]methanone
CID 130315755
[1-[(5-methyl-2-pyridinyl)methyl]piperidin-4-yl]methanamine
CID 81312464
2-[(3R)-1-(2-methoxyethyl)pyrrolidin-3-yl]-5-methyl-1H-imidazole
CID 125006103
2-[4-[[3-[(5-methyl-2-pyridinyl)methyl]pyrrolidin-1-yl]methyl]phenyl]benzoic acid
CID 110097255
N-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]-2-(4-methylpyrazol-1-yl)acetamide
CID 91836659
N-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]-1-(4-methylphenyl)methanesulfonamide
CID 131897813
5-bromo-2-[[3-(methoxymethyl)pyrrolidin-1-yl]methyl]pyridine
CID 115642522

Frequently Asked Questions

What is the IUPAC name of 2-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]-5-methylpyridine?
The IUPAC name of 2-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]-5-methylpyridine (CID 110269242) is 2-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]-5-methylpyridine.
What is the SMILES notation for 2-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]-5-methylpyridine?
The canonical SMILES for 2-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]-5-methylpyridine is COCCN1CCC(Cc2ccc(C)cn2)C1.
What is the InChIKey of 2-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]-5-methylpyridine?
The InChIKey is MYHSIINILPTVAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-12-3-4-14(15-10-12)9-13-5-6-16(11-13)7-8-17-2/h3-4,10,13H,5-9,11H2,1-2H3.
What are the key properties of 2-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]-5-methylpyridine?
2-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]-5-methylpyridine has a molecular weight of 234.34 g/mol, XLogP of 1.90, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]-5-methylpyridine is sourced from PubChem (CID 110269242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).