2-(2-methoxyphenyl)-1H-pyrrole

C11H11NO — CID 11126760

IUPAC2-(2-methoxyphenyl)-1H-pyrrole
SMILESCOc1ccccc1-c1ccc[nH]1
InChIInChI=1S/C11H11NO/c1-13-11-7-3-2-5-9(11)10-6-4-8-12-10/h2-8,12H,1H3
InChIKeyUCSKMYPSQKBZGR-UHFFFAOYSA-N
MW173.21 g/mol
LogP2.69
Rot. Bonds2

About 2-(2-methoxyphenyl)-1H-pyrrole

2-(2-methoxyphenyl)-1H-pyrrole (PubChem CID 11126760) has the molecular formula C11H11NO and a molecular weight of 173.21 g/mol. Its IUPAC name is 2-(2-methoxyphenyl)-1H-pyrrole.

Molecular Properties

Compound Name2-(2-methoxyphenyl)-1H-pyrrole
PubChem CID11126760
Molecular FormulaC11H11NO
Molecular Weight173.21 g/mol
Exact Mass173.08
IUPAC Name2-(2-methoxyphenyl)-1H-pyrrole
SMILESCOc1ccccc1-c1ccc[nH]1
InChIInChI=1S/C11H11NO/c1-13-11-7-3-2-5-9(11)10-6-4-8-12-10/h2-8,12H,1H3
InChIKeyUCSKMYPSQKBZGR-UHFFFAOYSA-N
XLogP2.69
TPSA25.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.21
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyphenyl)-1H-pyrrole?
The IUPAC name of 2-(2-methoxyphenyl)-1H-pyrrole (CID 11126760) is 2-(2-methoxyphenyl)-1H-pyrrole.
What is the SMILES notation for 2-(2-methoxyphenyl)-1H-pyrrole?
The canonical SMILES for 2-(2-methoxyphenyl)-1H-pyrrole is COc1ccccc1-c1ccc[nH]1.
What is the InChIKey of 2-(2-methoxyphenyl)-1H-pyrrole?
The InChIKey is UCSKMYPSQKBZGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO/c1-13-11-7-3-2-5-9(11)10-6-4-8-12-10/h2-8,12H,1H3.
What are the key properties of 2-(2-methoxyphenyl)-1H-pyrrole?
2-(2-methoxyphenyl)-1H-pyrrole has a molecular weight of 173.21 g/mol, XLogP of 2.69, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyphenyl)-1H-pyrrole is sourced from PubChem (CID 11126760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).