4-fluoro-N-(3-hydroxyphenyl)-1H-pyrrole-2-carboxamide

C11H9FN2O2 — CID 126771598

IUPAC4-fluoro-N-(3-hydroxyphenyl)-1H-pyrrole-2-carboxamide
SMILESO=C(Nc1cccc(O)c1)c1cc(F)c[nH]1
InChIInChI=1S/C11H9FN2O2/c12-7-4-10(13-6-7)11(16)14-8-2-1-3-9(15)5-8/h1-6,13,15H,(H,14,16)
InChIKeyAKMOHOSWDNATSV-UHFFFAOYSA-N
MW220.20 g/mol
LogP2.11
Rot. Bonds2

About 4-fluoro-N-(3-hydroxyphenyl)-1H-pyrrole-2-carboxamide

4-fluoro-N-(3-hydroxyphenyl)-1H-pyrrole-2-carboxamide (PubChem CID 126771598) has the molecular formula C11H9FN2O2 and a molecular weight of 220.20 g/mol. Its IUPAC name is 4-fluoro-N-(3-hydroxyphenyl)-1H-pyrrole-2-carboxamide.

Molecular Properties

Compound Name4-fluoro-N-(3-hydroxyphenyl)-1H-pyrrole-2-carboxamide
PubChem CID126771598
Molecular FormulaC11H9FN2O2
Molecular Weight220.20 g/mol
Exact Mass220.06
IUPAC Name4-fluoro-N-(3-hydroxyphenyl)-1H-pyrrole-2-carboxamide
SMILESO=C(Nc1cccc(O)c1)c1cc(F)c[nH]1
InChIInChI=1S/C11H9FN2O2/c12-7-4-10(13-6-7)11(16)14-8-2-1-3-9(15)5-8/h1-6,13,15H,(H,14,16)
InChIKeyAKMOHOSWDNATSV-UHFFFAOYSA-N
XLogP2.11
TPSA65.12 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.20
LogP ≤ 52.11
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-hydroxyphenyl)-1H-pyrrole-2-carboxamide
CID 28741153
4-acetyl-N-(3-fluorophenyl)-1H-pyrrole-2-carboxamide
CID 9072337
2-bromo-4-fluoro-N-(3-hydroxyphenyl)benzamide
CID 28739689
5-fluoro-N-(3-hydroxyphenyl)pyridine-3-carboxamide
CID 113287958
2,2-difluoro-N-(3-hydroxyphenyl)acetamide
CID 103600554
4-fluoro-N-methyl-1H-pyrrole-2-carboxamide
CID 130962748
4-acetamido-N-(3-hydroxyphenyl)benzamide
CID 110463964
2-chloro-4,5-difluoro-N-(3-hydroxyphenyl)benzamide
CID 78783752
4-chloro-2,5-difluoro-N-(3-hydroxyphenyl)benzamide
CID 82771176
4-amino-N-(3-chlorophenyl)-1H-pyrrole-2-carboxamide
CID 43642230
6-fluoro-N-(3-hydroxyphenyl)pyridine-3-carboxamide
CID 63979934
3-[(3-hydroxybenzoyl)amino]benzamide
CID 103605136

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-(3-hydroxyphenyl)-1H-pyrrole-2-carboxamide?
The IUPAC name of 4-fluoro-N-(3-hydroxyphenyl)-1H-pyrrole-2-carboxamide (CID 126771598) is 4-fluoro-N-(3-hydroxyphenyl)-1H-pyrrole-2-carboxamide.
What is the SMILES notation for 4-fluoro-N-(3-hydroxyphenyl)-1H-pyrrole-2-carboxamide?
The canonical SMILES for 4-fluoro-N-(3-hydroxyphenyl)-1H-pyrrole-2-carboxamide is O=C(Nc1cccc(O)c1)c1cc(F)c[nH]1.
What is the InChIKey of 4-fluoro-N-(3-hydroxyphenyl)-1H-pyrrole-2-carboxamide?
The InChIKey is AKMOHOSWDNATSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9FN2O2/c12-7-4-10(13-6-7)11(16)14-8-2-1-3-9(15)5-8/h1-6,13,15H,(H,14,16).
What are the key properties of 4-fluoro-N-(3-hydroxyphenyl)-1H-pyrrole-2-carboxamide?
4-fluoro-N-(3-hydroxyphenyl)-1H-pyrrole-2-carboxamide has a molecular weight of 220.20 g/mol, XLogP of 2.11, 2 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-(3-hydroxyphenyl)-1H-pyrrole-2-carboxamide is sourced from PubChem (CID 126771598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).