N-(2-cyano-1-benzofuran-3-yl)-2-(2-fluorophenoxy)acetamide

C17H11FN2O3 — CID 7560760

IUPACN-(2-cyano-1-benzofuran-3-yl)-2-(2-fluorophenoxy)acetamide
SMILESN#Cc1oc2ccccc2c1NC(=O)COc1ccccc1F
InChIInChI=1S/C17H11FN2O3/c18-12-6-2-4-8-14(12)22-10-16(21)20-17-11-5-1-3-7-13(11)23-15(17)9-19/h1-8H,10H2,(H,20,21)
InChIKeyQGDACPPDUCBWTR-UHFFFAOYSA-N
MW310.28 g/mol
LogP3.46
Rot. Bonds4

About N-(2-cyano-1-benzofuran-3-yl)-2-(2-fluorophenoxy)acetamide

N-(2-cyano-1-benzofuran-3-yl)-2-(2-fluorophenoxy)acetamide (PubChem CID 7560760) has the molecular formula C17H11FN2O3 and a molecular weight of 310.28 g/mol. Its IUPAC name is N-(2-cyano-1-benzofuran-3-yl)-2-(2-fluorophenoxy)acetamide.

Molecular Properties

Compound NameN-(2-cyano-1-benzofuran-3-yl)-2-(2-fluorophenoxy)acetamide
PubChem CID7560760
Molecular FormulaC17H11FN2O3
Molecular Weight310.28 g/mol
Exact Mass310.08
IUPAC NameN-(2-cyano-1-benzofuran-3-yl)-2-(2-fluorophenoxy)acetamide
SMILESN#Cc1oc2ccccc2c1NC(=O)COc1ccccc1F
InChIInChI=1S/C17H11FN2O3/c18-12-6-2-4-8-14(12)22-10-16(21)20-17-11-5-1-3-7-13(11)23-15(17)9-19/h1-8H,10H2,(H,20,21)
InChIKeyQGDACPPDUCBWTR-UHFFFAOYSA-N
XLogP3.46
TPSA75.26 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.28
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,6-difluorophenyl)-2-(2-fluorophenoxy)acetamide
CID 892688
2-(2-cyanophenoxy)-N-(2,6-difluorophenyl)acetamide
CID 2565570
[2-[(2-cyano-1-benzofuran-3-yl)amino]-2-oxoethyl] 3,3-dimethylbutanoate
CID 16524650
[2-[(2-cyano-1-benzofuran-3-yl)amino]-2-oxoethyl] 2-(benzylcarbamoylamino)acetate
CID 16576111
[2-[(2-cyano-1-benzofuran-3-yl)amino]-2-oxoethyl] 3-(3,4,5-trimethoxyphenyl)prop-2-enoate
CID 3990734
N-(2-cyano-1-benzofuran-3-yl)-2-methylpropanamide
CID 176860593
2-(2-fluorophenoxy)-N-[(4-fluorophenyl)methyl]acetamide
CID 7700855
N-[4-(methylamino)-2-oxochromen-3-yl]-2-(2-methylphenoxy)acetamide
CID 22433883
3-[[2-(4-fluorophenoxy)acetyl]amino]-N-(2-fluorophenyl)-1-benzofuran-2-carboxamide
CID 20875244
N-[4-(ethylamino)-2-oxochromen-3-yl]-2-(2-methylphenoxy)acetamide
CID 22433885
N-[2-(4-chlorobenzoyl)-1-benzofuran-3-yl]-2-(2-chlorophenoxy)acetamide
CID 3445771
N-(2-cyano-4-nitrophenyl)-2-(2-fluorophenoxy)acetamide
CID 7434030

Frequently Asked Questions

What is the IUPAC name of N-(2-cyano-1-benzofuran-3-yl)-2-(2-fluorophenoxy)acetamide?
The IUPAC name of N-(2-cyano-1-benzofuran-3-yl)-2-(2-fluorophenoxy)acetamide (CID 7560760) is N-(2-cyano-1-benzofuran-3-yl)-2-(2-fluorophenoxy)acetamide.
What is the SMILES notation for N-(2-cyano-1-benzofuran-3-yl)-2-(2-fluorophenoxy)acetamide?
The canonical SMILES for N-(2-cyano-1-benzofuran-3-yl)-2-(2-fluorophenoxy)acetamide is N#Cc1oc2ccccc2c1NC(=O)COc1ccccc1F.
What is the InChIKey of N-(2-cyano-1-benzofuran-3-yl)-2-(2-fluorophenoxy)acetamide?
The InChIKey is QGDACPPDUCBWTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11FN2O3/c18-12-6-2-4-8-14(12)22-10-16(21)20-17-11-5-1-3-7-13(11)23-15(17)9-19/h1-8H,10H2,(H,20,21).
What are the key properties of N-(2-cyano-1-benzofuran-3-yl)-2-(2-fluorophenoxy)acetamide?
N-(2-cyano-1-benzofuran-3-yl)-2-(2-fluorophenoxy)acetamide has a molecular weight of 310.28 g/mol, XLogP of 3.46, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyano-1-benzofuran-3-yl)-2-(2-fluorophenoxy)acetamide is sourced from PubChem (CID 7560760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).