1-[2-(difluoromethoxy)phenyl]pyrrole

C11H9F2NO — CID 2100735

IUPAC1-[2-(difluoromethoxy)phenyl]pyrrole
SMILESFC(F)Oc1ccccc1-n1cccc1
InChIInChI=1S/C11H9F2NO/c12-11(13)15-10-6-2-1-5-9(10)14-7-3-4-8-14/h1-8,11H
InChIKeyYKDPZTQMJCVQTP-UHFFFAOYSA-N
MW209.20 g/mol
LogP3.08
Rot. Bonds3

About 1-[2-(difluoromethoxy)phenyl]pyrrole

1-[2-(difluoromethoxy)phenyl]pyrrole (PubChem CID 2100735) has the molecular formula C11H9F2NO and a molecular weight of 209.20 g/mol. Its IUPAC name is 1-[2-(difluoromethoxy)phenyl]pyrrole.

Molecular Properties

Compound Name1-[2-(difluoromethoxy)phenyl]pyrrole
PubChem CID2100735
Molecular FormulaC11H9F2NO
Molecular Weight209.20 g/mol
Exact Mass209.07
IUPAC Name1-[2-(difluoromethoxy)phenyl]pyrrole
SMILESFC(F)Oc1ccccc1-n1cccc1
InChIInChI=1S/C11H9F2NO/c12-11(13)15-10-6-2-1-5-9(10)14-7-3-4-8-14/h1-8,11H
InChIKeyYKDPZTQMJCVQTP-UHFFFAOYSA-N
XLogP3.08
TPSA14.16 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.20
LogP ≤ 53.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(difluoromethoxy)phenyl]pyrrole?
The IUPAC name of 1-[2-(difluoromethoxy)phenyl]pyrrole (CID 2100735) is 1-[2-(difluoromethoxy)phenyl]pyrrole.
What is the SMILES notation for 1-[2-(difluoromethoxy)phenyl]pyrrole?
The canonical SMILES for 1-[2-(difluoromethoxy)phenyl]pyrrole is FC(F)Oc1ccccc1-n1cccc1.
What is the InChIKey of 1-[2-(difluoromethoxy)phenyl]pyrrole?
The InChIKey is YKDPZTQMJCVQTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9F2NO/c12-11(13)15-10-6-2-1-5-9(10)14-7-3-4-8-14/h1-8,11H.
What are the key properties of 1-[2-(difluoromethoxy)phenyl]pyrrole?
1-[2-(difluoromethoxy)phenyl]pyrrole has a molecular weight of 209.20 g/mol, XLogP of 3.08, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(difluoromethoxy)phenyl]pyrrole is sourced from PubChem (CID 2100735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).