N-[[5-(2-fluorophenyl)-1,2-oxazol-3-yl]methyl]-1-benzofuran-2-carboxamide

C19H13FN2O3 — CID 27370099

IUPACN-[[5-(2-fluorophenyl)-1,2-oxazol-3-yl]methyl]-1-benzofuran-2-carboxamide
SMILESO=C(NCc1cc(-c2ccccc2F)on1)c1cc2ccccc2o1
InChIInChI=1S/C19H13FN2O3/c20-15-7-3-2-6-14(15)17-10-13(22-25-17)11-21-19(23)18-9-12-5-1-4-8-16(12)24-18/h1-10H,11H2,(H,21,23)
InChIKeyXQUDMOIFAUNDDC-UHFFFAOYSA-N
MW336.32 g/mol
LogP4.16
Rot. Bonds4

About N-[[5-(2-fluorophenyl)-1,2-oxazol-3-yl]methyl]-1-benzofuran-2-carboxamide

N-[[5-(2-fluorophenyl)-1,2-oxazol-3-yl]methyl]-1-benzofuran-2-carboxamide (PubChem CID 27370099) has the molecular formula C19H13FN2O3 and a molecular weight of 336.32 g/mol. Its IUPAC name is N-[[5-(2-fluorophenyl)-1,2-oxazol-3-yl]methyl]-1-benzofuran-2-carboxamide.

Molecular Properties

Compound NameN-[[5-(2-fluorophenyl)-1,2-oxazol-3-yl]methyl]-1-benzofuran-2-carboxamide
PubChem CID27370099
Molecular FormulaC19H13FN2O3
Molecular Weight336.32 g/mol
Exact Mass336.09
IUPAC NameN-[[5-(2-fluorophenyl)-1,2-oxazol-3-yl]methyl]-1-benzofuran-2-carboxamide
SMILESO=C(NCc1cc(-c2ccccc2F)on1)c1cc2ccccc2o1
InChIInChI=1S/C19H13FN2O3/c20-15-7-3-2-6-14(15)17-10-13(22-25-17)11-21-19(23)18-9-12-5-1-4-8-16(12)24-18/h1-10H,11H2,(H,21,23)
InChIKeyXQUDMOIFAUNDDC-UHFFFAOYSA-N
XLogP4.16
TPSA68.27 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.32
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[5-(2,4-difluorophenyl)-1,2-oxazol-3-yl]methyl]-4-oxochromene-2-carboxamide
CID 27567867
N-[[5-(2-fluorophenyl)-1,2-oxazol-3-yl]methyl]cyclopropanecarboxamide
CID 27370057
N-(1-benzofuran-2-ylmethyl)-1-benzofuran-2-carboxamide
CID 86994462
N-[(2-methyl-1,3-thiazol-5-yl)methyl]-1-benzofuran-2-carboxamide
CID 86836271
4-oxo-N-[[5-(4-phenylphenyl)-1,2-oxazol-3-yl]methyl]chromene-2-carboxamide
CID 16867578
N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-1-benzofuran-2-carboxamide
CID 47344961
N-[[5-(1-benzofuran-2-yl)-1,2-oxazol-3-yl]methyl]cyclopropanecarboxamide
CID 30608149
2-(1,2-benzoxazol-3-yl)-N-[[5-(2,4-difluorophenyl)-1,2-oxazol-3-yl]methyl]acetamide
CID 45497823
N-(3-iodopropyl)-1-benzofuran-2-carboxamide
CID 114504013
N-[(4-acetylphenyl)methyl]-1-benzofuran-2-carboxamide
CID 20677387
N-[2-(3,4-dihydroxyphenyl)ethyl]-1-benzofuran-2-carboxamide
CID 78796682
N-[(3-bromothiophen-2-yl)methyl]-1-benzofuran-2-carboxamide
CID 78985913

Frequently Asked Questions

What is the IUPAC name of N-[[5-(2-fluorophenyl)-1,2-oxazol-3-yl]methyl]-1-benzofuran-2-carboxamide?
The IUPAC name of N-[[5-(2-fluorophenyl)-1,2-oxazol-3-yl]methyl]-1-benzofuran-2-carboxamide (CID 27370099) is N-[[5-(2-fluorophenyl)-1,2-oxazol-3-yl]methyl]-1-benzofuran-2-carboxamide.
What is the SMILES notation for N-[[5-(2-fluorophenyl)-1,2-oxazol-3-yl]methyl]-1-benzofuran-2-carboxamide?
The canonical SMILES for N-[[5-(2-fluorophenyl)-1,2-oxazol-3-yl]methyl]-1-benzofuran-2-carboxamide is O=C(NCc1cc(-c2ccccc2F)on1)c1cc2ccccc2o1.
What is the InChIKey of N-[[5-(2-fluorophenyl)-1,2-oxazol-3-yl]methyl]-1-benzofuran-2-carboxamide?
The InChIKey is XQUDMOIFAUNDDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13FN2O3/c20-15-7-3-2-6-14(15)17-10-13(22-25-17)11-21-19(23)18-9-12-5-1-4-8-16(12)24-18/h1-10H,11H2,(H,21,23).
What are the key properties of N-[[5-(2-fluorophenyl)-1,2-oxazol-3-yl]methyl]-1-benzofuran-2-carboxamide?
N-[[5-(2-fluorophenyl)-1,2-oxazol-3-yl]methyl]-1-benzofuran-2-carboxamide has a molecular weight of 336.32 g/mol, XLogP of 4.16, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(2-fluorophenyl)-1,2-oxazol-3-yl]methyl]-1-benzofuran-2-carboxamide is sourced from PubChem (CID 27370099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).