N-[(1S)-1-(1-benzofuran-2-yl)ethyl]-2-fluorobenzamide

C17H14FNO2 — CID 9367947

IUPACN-[(1S)-1-(1-benzofuran-2-yl)ethyl]-2-fluorobenzamide
SMILESC[C@H](NC(=O)c1ccccc1F)c1cc2ccccc2o1
InChIInChI=1S/C17H14FNO2/c1-11(16-10-12-6-2-5-9-15(12)21-16)19-17(20)13-7-3-4-8-14(13)18/h2-11H,1H3,(H,19,20)/t11-/m0/s1
InChIKeySFQLNWBYBJMXSG-NSHDSACASA-N
MW283.30 g/mol
LogP4.06
Rot. Bonds3

About N-[(1S)-1-(1-benzofuran-2-yl)ethyl]-2-fluorobenzamide

N-[(1S)-1-(1-benzofuran-2-yl)ethyl]-2-fluorobenzamide (PubChem CID 9367947) has the molecular formula C17H14FNO2 and a molecular weight of 283.30 g/mol. Its IUPAC name is N-[(1S)-1-(1-benzofuran-2-yl)ethyl]-2-fluorobenzamide.

Molecular Properties

Compound NameN-[(1S)-1-(1-benzofuran-2-yl)ethyl]-2-fluorobenzamide
PubChem CID9367947
Molecular FormulaC17H14FNO2
Molecular Weight283.30 g/mol
Exact Mass283.10
IUPAC NameN-[(1S)-1-(1-benzofuran-2-yl)ethyl]-2-fluorobenzamide
SMILESC[C@H](NC(=O)c1ccccc1F)c1cc2ccccc2o1
InChIInChI=1S/C17H14FNO2/c1-11(16-10-12-6-2-5-9-15(12)21-16)19-17(20)13-7-3-4-8-14(13)18/h2-11H,1H3,(H,19,20)/t11-/m0/s1
InChIKeySFQLNWBYBJMXSG-NSHDSACASA-N
XLogP4.06
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.30
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(1R)-1-(1-benzofuran-2-yl)ethyl]-1-benzofuran-2-carboxamide
CID 9366962
N-[(1S)-1-(1-benzofuran-2-yl)ethyl]-1-benzofuran-2-carboxamide
CID 9366960
N-[1-(1-benzofuran-2-yl)ethyl]-1-methyl-3-(trifluoromethyl)pyrazole-4-carboxamide
CID 87008411
N-[(1R)-1-(1-benzofuran-2-yl)ethyl]-4-(trifluoromethyl)benzamide
CID 9194058
N-[(1R)-1-(1-benzofuran-2-yl)ethyl]-6-fluoropyridine-3-carboxamide
CID 95318825
N-[(1S)-1-(1-benzofuran-2-yl)ethyl]furan-2-carboxamide
CID 41095457
N-[(1S)-1-(1-benzofuran-2-yl)ethyl]-2-methyl-5-methylsulfonylbenzamide
CID 51579914
N-[(1R)-1-(1-benzofuran-2-yl)ethyl]-4-chloro-2-nitrobenzamide
CID 9365928
N-[1-(1-benzofuran-2-yl)ethyl]-2,3-dimethyl-1H-indole-7-carboxamide
CID 43060113
N-[1-(1-benzofuran-2-yl)ethyl]-6-fluoro-2-sulfanylidene-1,3-dihydrobenzimidazole-4-carboxamide
CID 78904159
methyl 4-[[(1R)-1-(1-benzofuran-2-yl)ethyl]carbamoyl]benzoate
CID 9367253
N-[1-(1-benzofuran-2-yl)ethyl]-2-bromo-5-methoxybenzamide
CID 17496272

Frequently Asked Questions

What is the IUPAC name of N-[(1S)-1-(1-benzofuran-2-yl)ethyl]-2-fluorobenzamide?
The IUPAC name of N-[(1S)-1-(1-benzofuran-2-yl)ethyl]-2-fluorobenzamide (CID 9367947) is N-[(1S)-1-(1-benzofuran-2-yl)ethyl]-2-fluorobenzamide.
What is the SMILES notation for N-[(1S)-1-(1-benzofuran-2-yl)ethyl]-2-fluorobenzamide?
The canonical SMILES for N-[(1S)-1-(1-benzofuran-2-yl)ethyl]-2-fluorobenzamide is C[C@H](NC(=O)c1ccccc1F)c1cc2ccccc2o1.
What is the InChIKey of N-[(1S)-1-(1-benzofuran-2-yl)ethyl]-2-fluorobenzamide?
The InChIKey is SFQLNWBYBJMXSG-NSHDSACASA-N. The full InChI is InChI=1S/C17H14FNO2/c1-11(16-10-12-6-2-5-9-15(12)21-16)19-17(20)13-7-3-4-8-14(13)18/h2-11H,1H3,(H,19,20)/t11-/m0/s1.
What are the key properties of N-[(1S)-1-(1-benzofuran-2-yl)ethyl]-2-fluorobenzamide?
N-[(1S)-1-(1-benzofuran-2-yl)ethyl]-2-fluorobenzamide has a molecular weight of 283.30 g/mol, XLogP of 4.06, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S)-1-(1-benzofuran-2-yl)ethyl]-2-fluorobenzamide is sourced from PubChem (CID 9367947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).