1-[2-(2-methoxyphenoxy)ethyl]pyrrole

C13H15NO2 — CID 60650106

IUPAC1-[2-(2-methoxyphenoxy)ethyl]pyrrole
SMILESCOc1ccccc1OCCn1cccc1
InChIInChI=1S/C13H15NO2/c1-15-12-6-2-3-7-13(12)16-11-10-14-8-4-5-9-14/h2-9H,10-11H2,1H3
InChIKeyPUCOISISXVCMHQ-UHFFFAOYSA-N
MW217.27 g/mol
LogP2.58
Rot. Bonds5

About 1-[2-(2-methoxyphenoxy)ethyl]pyrrole

1-[2-(2-methoxyphenoxy)ethyl]pyrrole (PubChem CID 60650106) has the molecular formula C13H15NO2 and a molecular weight of 217.27 g/mol. Its IUPAC name is 1-[2-(2-methoxyphenoxy)ethyl]pyrrole.

Molecular Properties

Compound Name1-[2-(2-methoxyphenoxy)ethyl]pyrrole
PubChem CID60650106
Molecular FormulaC13H15NO2
Molecular Weight217.27 g/mol
Exact Mass217.11
IUPAC Name1-[2-(2-methoxyphenoxy)ethyl]pyrrole
SMILESCOc1ccccc1OCCn1cccc1
InChIInChI=1S/C13H15NO2/c1-15-12-6-2-3-7-13(12)16-11-10-14-8-4-5-9-14/h2-9H,10-11H2,1H3
InChIKeyPUCOISISXVCMHQ-UHFFFAOYSA-N
XLogP2.58
TPSA23.39 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.27
LogP ≤ 52.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-methoxy-3-(2-pyrrol-1-ylethoxy)benzaldehyde
CID 141375491
1-methoxy-2-[12-(2-methoxyphenoxy)dodecoxy]benzene
CID 134880850
1-[2-(2-methoxyphenoxy)ethyl]piperidine
CID 867242
1-[2-(2-methoxyphenoxy)ethyl]-3-propylimidazol-2-one
CID 116624789
1-[1-[2-(2-methoxyphenoxy)ethyl]pyrrol-3-yl]butan-1-amine
CID 79108388
1-[2-(2-methoxyphenoxy)ethyl]pyrrole-2-carbonitrile
CID 114652751
2-(2-methoxyphenoxy)ethyl-methylazanium
CID 7438015
1-(4-chlorobutoxy)-2-methoxybenzene
CID 22048718
3-bromo-1-[2-(2-methoxyphenoxy)ethyl]pyridin-2-one
CID 114761431
1-[2-(2-methoxyphenoxy)ethyl]piperidin-4-one
CID 19794408
1-[2-(2-methoxyphenoxy)ethyl]-2,2,6,6-tetramethylpiperidine
CID 141005343
1-[1-[2-(2-methoxyphenoxy)ethyl]imidazol-4-yl]propan-2-amine
CID 106721116

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-methoxyphenoxy)ethyl]pyrrole?
The IUPAC name of 1-[2-(2-methoxyphenoxy)ethyl]pyrrole (CID 60650106) is 1-[2-(2-methoxyphenoxy)ethyl]pyrrole.
What is the SMILES notation for 1-[2-(2-methoxyphenoxy)ethyl]pyrrole?
The canonical SMILES for 1-[2-(2-methoxyphenoxy)ethyl]pyrrole is COc1ccccc1OCCn1cccc1.
What is the InChIKey of 1-[2-(2-methoxyphenoxy)ethyl]pyrrole?
The InChIKey is PUCOISISXVCMHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO2/c1-15-12-6-2-3-7-13(12)16-11-10-14-8-4-5-9-14/h2-9H,10-11H2,1H3.
What are the key properties of 1-[2-(2-methoxyphenoxy)ethyl]pyrrole?
1-[2-(2-methoxyphenoxy)ethyl]pyrrole has a molecular weight of 217.27 g/mol, XLogP of 2.58, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-methoxyphenoxy)ethyl]pyrrole is sourced from PubChem (CID 60650106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).