[5-(2-fluoroethoxy)thiophen-2-yl]-(1H-pyrrol-2-yl)methanone

C11H10FNO2S — CID 175992477

IUPAC[5-(2-fluoroethoxy)thiophen-2-yl]-(1H-pyrrol-2-yl)methanone
SMILESO=C(c1ccc[nH]1)c1ccc(OCCF)s1
InChIInChI=1S/C11H10FNO2S/c12-5-7-15-10-4-3-9(16-10)11(14)8-2-1-6-13-8/h1-4,6,13H,5,7H2
InChIKeyHJMQIYHOAHWNQV-UHFFFAOYSA-N
MW239.27 g/mol
LogP2.66
Rot. Bonds5

About [5-(2-fluoroethoxy)thiophen-2-yl]-(1H-pyrrol-2-yl)methanone

[5-(2-fluoroethoxy)thiophen-2-yl]-(1H-pyrrol-2-yl)methanone (PubChem CID 175992477) has the molecular formula C11H10FNO2S and a molecular weight of 239.27 g/mol. Its IUPAC name is [5-(2-fluoroethoxy)thiophen-2-yl]-(1H-pyrrol-2-yl)methanone.

Molecular Properties

Compound Name[5-(2-fluoroethoxy)thiophen-2-yl]-(1H-pyrrol-2-yl)methanone
PubChem CID175992477
Molecular FormulaC11H10FNO2S
Molecular Weight239.27 g/mol
Exact Mass239.04
IUPAC Name[5-(2-fluoroethoxy)thiophen-2-yl]-(1H-pyrrol-2-yl)methanone
SMILESO=C(c1ccc[nH]1)c1ccc(OCCF)s1
InChIInChI=1S/C11H10FNO2S/c12-5-7-15-10-4-3-9(16-10)11(14)8-2-1-6-13-8/h1-4,6,13H,5,7H2
InChIKeyHJMQIYHOAHWNQV-UHFFFAOYSA-N
XLogP2.66
TPSA42.09 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.27
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [5-(2-fluoroethoxy)thiophen-2-yl]-(1H-pyrrol-2-yl)methanone?
The IUPAC name of [5-(2-fluoroethoxy)thiophen-2-yl]-(1H-pyrrol-2-yl)methanone (CID 175992477) is [5-(2-fluoroethoxy)thiophen-2-yl]-(1H-pyrrol-2-yl)methanone.
What is the SMILES notation for [5-(2-fluoroethoxy)thiophen-2-yl]-(1H-pyrrol-2-yl)methanone?
The canonical SMILES for [5-(2-fluoroethoxy)thiophen-2-yl]-(1H-pyrrol-2-yl)methanone is O=C(c1ccc[nH]1)c1ccc(OCCF)s1.
What is the InChIKey of [5-(2-fluoroethoxy)thiophen-2-yl]-(1H-pyrrol-2-yl)methanone?
The InChIKey is HJMQIYHOAHWNQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10FNO2S/c12-5-7-15-10-4-3-9(16-10)11(14)8-2-1-6-13-8/h1-4,6,13H,5,7H2.
What are the key properties of [5-(2-fluoroethoxy)thiophen-2-yl]-(1H-pyrrol-2-yl)methanone?
[5-(2-fluoroethoxy)thiophen-2-yl]-(1H-pyrrol-2-yl)methanone has a molecular weight of 239.27 g/mol, XLogP of 2.66, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(2-fluoroethoxy)thiophen-2-yl]-(1H-pyrrol-2-yl)methanone is sourced from PubChem (CID 175992477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).