N-(1-benzofuran-2-ylmethyl)-2-fluoro-N-methylbenzamide

C17H14FNO2 — CID 110732902

IUPACN-(1-benzofuran-2-ylmethyl)-2-fluoro-N-methylbenzamide
SMILESCN(Cc1cc2ccccc2o1)C(=O)c1ccccc1F
InChIInChI=1S/C17H14FNO2/c1-19(17(20)14-7-3-4-8-15(14)18)11-13-10-12-6-2-5-9-16(12)21-13/h2-10H,11H2,1H3
InChIKeyGFWVXVVCBHOVGQ-UHFFFAOYSA-N
MW283.30 g/mol
LogP3.84
Rot. Bonds3

About N-(1-benzofuran-2-ylmethyl)-2-fluoro-N-methylbenzamide

N-(1-benzofuran-2-ylmethyl)-2-fluoro-N-methylbenzamide (PubChem CID 110732902) has the molecular formula C17H14FNO2 and a molecular weight of 283.30 g/mol. Its IUPAC name is N-(1-benzofuran-2-ylmethyl)-2-fluoro-N-methylbenzamide.

Molecular Properties

Compound NameN-(1-benzofuran-2-ylmethyl)-2-fluoro-N-methylbenzamide
PubChem CID110732902
Molecular FormulaC17H14FNO2
Molecular Weight283.30 g/mol
Exact Mass283.10
IUPAC NameN-(1-benzofuran-2-ylmethyl)-2-fluoro-N-methylbenzamide
SMILESCN(Cc1cc2ccccc2o1)C(=O)c1ccccc1F
InChIInChI=1S/C17H14FNO2/c1-19(17(20)14-7-3-4-8-15(14)18)11-13-10-12-6-2-5-9-16(12)21-13/h2-10H,11H2,1H3
InChIKeyGFWVXVVCBHOVGQ-UHFFFAOYSA-N
XLogP3.84
TPSA33.45 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.30
LogP ≤ 53.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-benzofuran-2-ylmethyl)-N-methylpyridine-2-carboxamide
CID 110745356
N-(1-benzofuran-2-ylmethyl)-N,2-dimethylpropanamide
CID 110732890
methyl 5-[[(2-fluorobenzoyl)-methylamino]methyl]-2-methylfuran-3-carboxylate
CID 31711214
N-(1-benzofuran-2-ylmethyl)-N,3-dimethylbutanamide
CID 110732893
3-[[1-benzofuran-2-ylmethyl(methyl)carbamoyl]amino]propanoic acid
CID 122018707
2-[1-benzofuran-2-ylmethyl(methyl)amino]acetic acid;hydrochloride
CID 119032828
2-fluoro-N-methyl-N-(quinolin-3-ylmethyl)benzamide
CID 110733867
2-fluoro-N-[(4-methoxyphenyl)methyl]-N-methylbenzamide
CID 60631214
N-[[3-(aminomethyl)phenyl]methyl]-2-fluoro-N-methylbenzamide
CID 43248666
N-(1-benzofuran-2-ylmethyl)-N-methyl-2-(3-methylphenoxy)acetamide
CID 110732938
N-(1-benzofuran-2-ylmethyl)-3-(4-methoxyphenyl)-N-methylpropanamide
CID 110732927
1-(1-benzofuran-2-ylmethyl)-1,2-dimethyl-3-(3,3,3-trifluoropropyl)guanidine
CID 111991121

Frequently Asked Questions

What is the IUPAC name of N-(1-benzofuran-2-ylmethyl)-2-fluoro-N-methylbenzamide?
The IUPAC name of N-(1-benzofuran-2-ylmethyl)-2-fluoro-N-methylbenzamide (CID 110732902) is N-(1-benzofuran-2-ylmethyl)-2-fluoro-N-methylbenzamide.
What is the SMILES notation for N-(1-benzofuran-2-ylmethyl)-2-fluoro-N-methylbenzamide?
The canonical SMILES for N-(1-benzofuran-2-ylmethyl)-2-fluoro-N-methylbenzamide is CN(Cc1cc2ccccc2o1)C(=O)c1ccccc1F.
What is the InChIKey of N-(1-benzofuran-2-ylmethyl)-2-fluoro-N-methylbenzamide?
The InChIKey is GFWVXVVCBHOVGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14FNO2/c1-19(17(20)14-7-3-4-8-15(14)18)11-13-10-12-6-2-5-9-16(12)21-13/h2-10H,11H2,1H3.
What are the key properties of N-(1-benzofuran-2-ylmethyl)-2-fluoro-N-methylbenzamide?
N-(1-benzofuran-2-ylmethyl)-2-fluoro-N-methylbenzamide has a molecular weight of 283.30 g/mol, XLogP of 3.84, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-benzofuran-2-ylmethyl)-2-fluoro-N-methylbenzamide is sourced from PubChem (CID 110732902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).