3-[(5-methyl-1,2-dihydropyrrol-5-yl)methoxy]pyridine

C11H14N2O — CID 75009780

IUPAC3-[(5-methyl-1,2-dihydropyrrol-5-yl)methoxy]pyridine
SMILESCC1(COc2cccnc2)C=CCN1
InChIInChI=1S/C11H14N2O/c1-11(5-3-7-13-11)9-14-10-4-2-6-12-8-10/h2-6,8,13H,7,9H2,1H3
InChIKeyFMTFDGYDXZUOGU-UHFFFAOYSA-N
MW190.25 g/mol
LogP1.38
Rot. Bonds3

About 3-[(5-methyl-1,2-dihydropyrrol-5-yl)methoxy]pyridine

3-[(5-methyl-1,2-dihydropyrrol-5-yl)methoxy]pyridine (PubChem CID 75009780) has the molecular formula C11H14N2O and a molecular weight of 190.25 g/mol. Its IUPAC name is 3-[(5-methyl-1,2-dihydropyrrol-5-yl)methoxy]pyridine.

Molecular Properties

Compound Name3-[(5-methyl-1,2-dihydropyrrol-5-yl)methoxy]pyridine
PubChem CID75009780
Molecular FormulaC11H14N2O
Molecular Weight190.25 g/mol
Exact Mass190.11
IUPAC Name3-[(5-methyl-1,2-dihydropyrrol-5-yl)methoxy]pyridine
SMILESCC1(COc2cccnc2)C=CCN1
InChIInChI=1S/C11H14N2O/c1-11(5-3-7-13-11)9-14-10-4-2-6-12-8-10/h2-6,8,13H,7,9H2,1H3
InChIKeyFMTFDGYDXZUOGU-UHFFFAOYSA-N
XLogP1.38
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

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cis-(1R,2S)-N,2-dimethyl-1-(pyridin-3-yloxymethyl)cyclopropan-1-amine
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4-[(dimethylamino)methyl]-4-(pyridin-3-yloxymethyl)cyclopentane-1,2-diol
CID 162796182
[4-(pyridin-3-yloxymethyl)oxan-4-yl]methanamine
CID 117051343
3-(3-phenoxypropoxy)pyridine
CID 86195847
3-octadecoxypyridine
CID 175800212
3-[[(2R)-azetidin-2-yl]methoxy]pyridine;dihydrochloride
CID 18391704
3-[2-(azetidin-3-yl)ethoxy]pyridine
CID 107391839
2-(pyridin-3-yloxymethyl)-1,3-oxazole
CID 54003976
3-[(4-methylphenyl)methoxy]pyridine
CID 58445986
4-methyl-2-pyridin-3-yloxypyrimidine
CID 155798550

Frequently Asked Questions

What is the IUPAC name of 3-[(5-methyl-1,2-dihydropyrrol-5-yl)methoxy]pyridine?
The IUPAC name of 3-[(5-methyl-1,2-dihydropyrrol-5-yl)methoxy]pyridine (CID 75009780) is 3-[(5-methyl-1,2-dihydropyrrol-5-yl)methoxy]pyridine.
What is the SMILES notation for 3-[(5-methyl-1,2-dihydropyrrol-5-yl)methoxy]pyridine?
The canonical SMILES for 3-[(5-methyl-1,2-dihydropyrrol-5-yl)methoxy]pyridine is CC1(COc2cccnc2)C=CCN1.
What is the InChIKey of 3-[(5-methyl-1,2-dihydropyrrol-5-yl)methoxy]pyridine?
The InChIKey is FMTFDGYDXZUOGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O/c1-11(5-3-7-13-11)9-14-10-4-2-6-12-8-10/h2-6,8,13H,7,9H2,1H3.
What are the key properties of 3-[(5-methyl-1,2-dihydropyrrol-5-yl)methoxy]pyridine?
3-[(5-methyl-1,2-dihydropyrrol-5-yl)methoxy]pyridine has a molecular weight of 190.25 g/mol, XLogP of 1.38, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(5-methyl-1,2-dihydropyrrol-5-yl)methoxy]pyridine is sourced from PubChem (CID 75009780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).