N-(2-fluorophenyl)-7-methyl-1-benzofuran-2-carboxamide

C16H12FNO2 — CID 48980668

IUPACN-(2-fluorophenyl)-7-methyl-1-benzofuran-2-carboxamide
SMILESCc1cccc2cc(C(=O)Nc3ccccc3F)oc12
InChIInChI=1S/C16H12FNO2/c1-10-5-4-6-11-9-14(20-15(10)11)16(19)18-13-8-3-2-7-12(13)17/h2-9H,1H3,(H,18,19)
InChIKeyYYNOJBINOQAORA-UHFFFAOYSA-N
MW269.27 g/mol
LogP4.13
Rot. Bonds2

About N-(2-fluorophenyl)-7-methyl-1-benzofuran-2-carboxamide

N-(2-fluorophenyl)-7-methyl-1-benzofuran-2-carboxamide (PubChem CID 48980668) has the molecular formula C16H12FNO2 and a molecular weight of 269.27 g/mol. Its IUPAC name is N-(2-fluorophenyl)-7-methyl-1-benzofuran-2-carboxamide.

Molecular Properties

Compound NameN-(2-fluorophenyl)-7-methyl-1-benzofuran-2-carboxamide
PubChem CID48980668
Molecular FormulaC16H12FNO2
Molecular Weight269.27 g/mol
Exact Mass269.09
IUPAC NameN-(2-fluorophenyl)-7-methyl-1-benzofuran-2-carboxamide
SMILESCc1cccc2cc(C(=O)Nc3ccccc3F)oc12
InChIInChI=1S/C16H12FNO2/c1-10-5-4-6-11-9-14(20-15(10)11)16(19)18-13-8-3-2-7-12(13)17/h2-9H,1H3,(H,18,19)
InChIKeyYYNOJBINOQAORA-UHFFFAOYSA-N
XLogP4.13
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.27
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-ethylphenyl)-7-methyl-1-benzofuran-2-carboxamide
CID 48981916
7-bromo-N-(2,3-dimethylphenyl)-1-benzofuran-2-carboxamide
CID 38885789
N-(3,5-dichlorophenyl)-7-methyl-1-benzofuran-2-carboxamide
CID 100795319
2-(2-fluorophenyl)-1-(7-methyl-1-benzofuran-2-yl)ethanone
CID 114725093
N-tert-butyl-7-methyl-1-benzofuran-2-carboxamide
CID 48980635
N-(2-fluorophenyl)-5-methylfuran-2-carboxamide
CID 3297570
N-(2-aminophenyl)-6,7-dimethyl-1-benzofuran-2-carboxamide
CID 91099174
5-chloro-N-(2-fluorophenyl)-1-benzofuran-2-carboxamide
CID 9138991
1-(7-methyl-1-benzofuran-2-yl)ethanone
CID 14468440
7-bromo-N-(2-methylsulfanylphenyl)-1-benzofuran-2-carboxamide
CID 46450792
7-bromo-N-(2,5-difluorophenyl)-1-benzofuran-2-carboxamide
CID 38897845
N-(2,3-dimethylphenyl)-7-ethoxy-1-benzofuran-2-carboxamide
CID 40888863

Frequently Asked Questions

What is the IUPAC name of N-(2-fluorophenyl)-7-methyl-1-benzofuran-2-carboxamide?
The IUPAC name of N-(2-fluorophenyl)-7-methyl-1-benzofuran-2-carboxamide (CID 48980668) is N-(2-fluorophenyl)-7-methyl-1-benzofuran-2-carboxamide.
What is the SMILES notation for N-(2-fluorophenyl)-7-methyl-1-benzofuran-2-carboxamide?
The canonical SMILES for N-(2-fluorophenyl)-7-methyl-1-benzofuran-2-carboxamide is Cc1cccc2cc(C(=O)Nc3ccccc3F)oc12.
What is the InChIKey of N-(2-fluorophenyl)-7-methyl-1-benzofuran-2-carboxamide?
The InChIKey is YYNOJBINOQAORA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12FNO2/c1-10-5-4-6-11-9-14(20-15(10)11)16(19)18-13-8-3-2-7-12(13)17/h2-9H,1H3,(H,18,19).
What are the key properties of N-(2-fluorophenyl)-7-methyl-1-benzofuran-2-carboxamide?
N-(2-fluorophenyl)-7-methyl-1-benzofuran-2-carboxamide has a molecular weight of 269.27 g/mol, XLogP of 4.13, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluorophenyl)-7-methyl-1-benzofuran-2-carboxamide is sourced from PubChem (CID 48980668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).