N-(2-fluorophenyl)-1H-pyrrole-2-carboxamide

C11H9FN2O — CID 51210810

IUPACN-(2-fluorophenyl)-1H-pyrrole-2-carboxamide
SMILESO=C(Nc1ccccc1F)c1ccc[nH]1
InChIInChI=1S/C11H9FN2O/c12-8-4-1-2-5-9(8)14-11(15)10-6-3-7-13-10/h1-7,13H,(H,14,15)
InChIKeyWZIKDXINSRDYBJ-UHFFFAOYSA-N
MW204.20 g/mol
LogP2.41
Rot. Bonds2

About N-(2-fluorophenyl)-1H-pyrrole-2-carboxamide

N-(2-fluorophenyl)-1H-pyrrole-2-carboxamide (PubChem CID 51210810) has the molecular formula C11H9FN2O and a molecular weight of 204.20 g/mol. Its IUPAC name is N-(2-fluorophenyl)-1H-pyrrole-2-carboxamide.

Molecular Properties

Compound NameN-(2-fluorophenyl)-1H-pyrrole-2-carboxamide
PubChem CID51210810
Molecular FormulaC11H9FN2O
Molecular Weight204.20 g/mol
Exact Mass204.07
IUPAC NameN-(2-fluorophenyl)-1H-pyrrole-2-carboxamide
SMILESO=C(Nc1ccccc1F)c1ccc[nH]1
InChIInChI=1S/C11H9FN2O/c12-8-4-1-2-5-9(8)14-11(15)10-6-3-7-13-10/h1-7,13H,(H,14,15)
InChIKeyWZIKDXINSRDYBJ-UHFFFAOYSA-N
XLogP2.41
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.20
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(2-fluorophenyl)-1H-pyrrole-2-carboxamide?
The IUPAC name of N-(2-fluorophenyl)-1H-pyrrole-2-carboxamide (CID 51210810) is N-(2-fluorophenyl)-1H-pyrrole-2-carboxamide.
What is the SMILES notation for N-(2-fluorophenyl)-1H-pyrrole-2-carboxamide?
The canonical SMILES for N-(2-fluorophenyl)-1H-pyrrole-2-carboxamide is O=C(Nc1ccccc1F)c1ccc[nH]1.
What is the InChIKey of N-(2-fluorophenyl)-1H-pyrrole-2-carboxamide?
The InChIKey is WZIKDXINSRDYBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9FN2O/c12-8-4-1-2-5-9(8)14-11(15)10-6-3-7-13-10/h1-7,13H,(H,14,15).
What are the key properties of N-(2-fluorophenyl)-1H-pyrrole-2-carboxamide?
N-(2-fluorophenyl)-1H-pyrrole-2-carboxamide has a molecular weight of 204.20 g/mol, XLogP of 2.41, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluorophenyl)-1H-pyrrole-2-carboxamide is sourced from PubChem (CID 51210810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).