N-(2-amino-5-fluorophenyl)-2-chlorofuran-3-carboxamide

C11H8ClFN2O2 — CID 106683261

IUPACN-(2-amino-5-fluorophenyl)-2-chlorofuran-3-carboxamide
SMILESNc1ccc(F)cc1NC(=O)c1ccoc1Cl
InChIInChI=1S/C11H8ClFN2O2/c12-10-7(3-4-17-10)11(16)15-9-5-6(13)1-2-8(9)14/h1-5H,14H2,(H,15,16)
InChIKeyOLPMNNXJUWNBPX-UHFFFAOYSA-N
MW254.65 g/mol
LogP2.91
Rot. Bonds2

About N-(2-amino-5-fluorophenyl)-2-chlorofuran-3-carboxamide

N-(2-amino-5-fluorophenyl)-2-chlorofuran-3-carboxamide (PubChem CID 106683261) has the molecular formula C11H8ClFN2O2 and a molecular weight of 254.65 g/mol. Its IUPAC name is N-(2-amino-5-fluorophenyl)-2-chlorofuran-3-carboxamide.

Molecular Properties

Compound NameN-(2-amino-5-fluorophenyl)-2-chlorofuran-3-carboxamide
PubChem CID106683261
Molecular FormulaC11H8ClFN2O2
Molecular Weight254.65 g/mol
Exact Mass254.03
IUPAC NameN-(2-amino-5-fluorophenyl)-2-chlorofuran-3-carboxamide
SMILESNc1ccc(F)cc1NC(=O)c1ccoc1Cl
InChIInChI=1S/C11H8ClFN2O2/c12-10-7(3-4-17-10)11(16)15-9-5-6(13)1-2-8(9)14/h1-5H,14H2,(H,15,16)
InChIKeyOLPMNNXJUWNBPX-UHFFFAOYSA-N
XLogP2.91
TPSA68.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.65
LogP ≤ 52.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-chloro-N-(2,4-difluorophenyl)furan-3-carboxamide
CID 106685284
N-(2-amino-5-fluorophenyl)-5-chloro-2-fluorobenzamide
CID 63257209
2-chloro-N-(4-chloro-2-fluorophenyl)furan-3-carboxamide
CID 106685654
N-(2-amino-5-fluorophenyl)-5-chloro-2-methylbenzamide
CID 82881025
N-(2-amino-4-bromophenyl)-2-chlorofuran-3-carboxamide
CID 106683097
N-(2-amino-5-fluorophenyl)-5-fluoro-2-hydroxybenzamide
CID 115298392
N-(2-amino-5-fluorophenyl)-3-chloro-2-methylbenzamide
CID 110484078
2-chloro-N-(2,5-difluoro-4-methylphenyl)furan-3-carboxamide
CID 106687388
N-[4-amino-2-(trifluoromethyl)phenyl]-2-chlorofuran-3-carboxamide
CID 106683164
N-(2-amino-5-fluorophenyl)-2-hydroxy-5-methylbenzamide
CID 55169166
N-(5-carbamoyl-2-chlorophenyl)-2-chlorofuran-3-carboxamide
CID 106685896
N-(2-amino-4-fluorophenyl)-2-ethylfuran-3-carboxamide
CID 114102845

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-5-fluorophenyl)-2-chlorofuran-3-carboxamide?
The IUPAC name of N-(2-amino-5-fluorophenyl)-2-chlorofuran-3-carboxamide (CID 106683261) is N-(2-amino-5-fluorophenyl)-2-chlorofuran-3-carboxamide.
What is the SMILES notation for N-(2-amino-5-fluorophenyl)-2-chlorofuran-3-carboxamide?
The canonical SMILES for N-(2-amino-5-fluorophenyl)-2-chlorofuran-3-carboxamide is Nc1ccc(F)cc1NC(=O)c1ccoc1Cl.
What is the InChIKey of N-(2-amino-5-fluorophenyl)-2-chlorofuran-3-carboxamide?
The InChIKey is OLPMNNXJUWNBPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8ClFN2O2/c12-10-7(3-4-17-10)11(16)15-9-5-6(13)1-2-8(9)14/h1-5H,14H2,(H,15,16).
What are the key properties of N-(2-amino-5-fluorophenyl)-2-chlorofuran-3-carboxamide?
N-(2-amino-5-fluorophenyl)-2-chlorofuran-3-carboxamide has a molecular weight of 254.65 g/mol, XLogP of 2.91, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-5-fluorophenyl)-2-chlorofuran-3-carboxamide is sourced from PubChem (CID 106683261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).