2-(2-cyanophenoxy)-N-[2-(3-fluorophenyl)-3H-benzimidazol-5-yl]acetamide

C22H15FN4O2 — CID 55901129

IUPAC2-(2-cyanophenoxy)-N-[2-(3-fluorophenyl)-3H-benzimidazol-5-yl]acetamide
SMILESN#Cc1ccccc1OCC(=O)Nc1ccc2nc(-c3cccc(F)c3)[nH]c2c1
InChIInChI=1S/C22H15FN4O2/c23-16-6-3-5-14(10-16)22-26-18-9-8-17(11-19(18)27-22)25-21(28)13-29-20-7-2-1-4-15(20)12-24/h1-11H,13H2,(H,25,28)(H,26,27)
InChIKeyVLEUBCOLUZGMOC-UHFFFAOYSA-N
MW386.39 g/mol
LogP4.26
Rot. Bonds5

About 2-(2-cyanophenoxy)-N-[2-(3-fluorophenyl)-3H-benzimidazol-5-yl]acetamide

2-(2-cyanophenoxy)-N-[2-(3-fluorophenyl)-3H-benzimidazol-5-yl]acetamide (PubChem CID 55901129) has the molecular formula C22H15FN4O2 and a molecular weight of 386.39 g/mol. Its IUPAC name is 2-(2-cyanophenoxy)-N-[2-(3-fluorophenyl)-3H-benzimidazol-5-yl]acetamide.

Molecular Properties

Compound Name2-(2-cyanophenoxy)-N-[2-(3-fluorophenyl)-3H-benzimidazol-5-yl]acetamide
PubChem CID55901129
Molecular FormulaC22H15FN4O2
Molecular Weight386.39 g/mol
Exact Mass386.12
IUPAC Name2-(2-cyanophenoxy)-N-[2-(3-fluorophenyl)-3H-benzimidazol-5-yl]acetamide
SMILESN#Cc1ccccc1OCC(=O)Nc1ccc2nc(-c3cccc(F)c3)[nH]c2c1
InChIInChI=1S/C22H15FN4O2/c23-16-6-3-5-14(10-16)22-26-18-9-8-17(11-19(18)27-22)25-21(28)13-29-20-7-2-1-4-15(20)12-24/h1-11H,13H2,(H,25,28)(H,26,27)
InChIKeyVLEUBCOLUZGMOC-UHFFFAOYSA-N
XLogP4.26
TPSA90.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.39
LogP ≤ 54.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(4-fluorophenyl)-3H-benzimidazol-5-yl]-2-phenoxyacetamide
CID 55726124
2-(2-cyanophenoxy)-N-[(6-fluoro-1H-benzimidazol-2-yl)methyl]acetamide
CID 71985123
N-[2-(3-fluorophenyl)-3H-benzimidazol-5-yl]-2-methylbutanamide
CID 60534062
N-[4-(1H-benzimidazol-2-yl)phenyl]-2-(2-fluorophenoxy)acetamide
CID 40704455
3-[[2-(2-cyanophenoxy)acetyl]amino]benzamide
CID 78779251
N-[4-(6-chloro-1H-benzimidazol-2-yl)phenyl]-2-(2-chlorophenoxy)acetamide
CID 17296439
2-[2-[4-(6-fluoro-1H-benzimidazol-2-yl)anilino]-2-oxoethoxy]acetic acid
CID 118717495
2-(2-cyanophenoxy)-N-(6-fluoro-1,3-benzothiazol-2-yl)acetamide
CID 7733369
2-(2-cyanophenoxy)-N-(4-fluoro-3-methylphenyl)acetamide
CID 62812512
1-(3-cyanophenyl)-3-[3-[3-(6-fluoro-1H-benzimidazol-2-yl)phenyl]phenyl]urea
CID 44525377
2-(difluoromethyl)-N-[2-(3-fluorophenyl)-3H-benzimidazol-5-yl]-3H-benzimidazole-5-carboxamide
CID 56561489
methyl 2-(3-fluorophenyl)-3H-benzimidazole-5-carboxylate
CID 56737080

Frequently Asked Questions

What is the IUPAC name of 2-(2-cyanophenoxy)-N-[2-(3-fluorophenyl)-3H-benzimidazol-5-yl]acetamide?
The IUPAC name of 2-(2-cyanophenoxy)-N-[2-(3-fluorophenyl)-3H-benzimidazol-5-yl]acetamide (CID 55901129) is 2-(2-cyanophenoxy)-N-[2-(3-fluorophenyl)-3H-benzimidazol-5-yl]acetamide.
What is the SMILES notation for 2-(2-cyanophenoxy)-N-[2-(3-fluorophenyl)-3H-benzimidazol-5-yl]acetamide?
The canonical SMILES for 2-(2-cyanophenoxy)-N-[2-(3-fluorophenyl)-3H-benzimidazol-5-yl]acetamide is N#Cc1ccccc1OCC(=O)Nc1ccc2nc(-c3cccc(F)c3)[nH]c2c1.
What is the InChIKey of 2-(2-cyanophenoxy)-N-[2-(3-fluorophenyl)-3H-benzimidazol-5-yl]acetamide?
The InChIKey is VLEUBCOLUZGMOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H15FN4O2/c23-16-6-3-5-14(10-16)22-26-18-9-8-17(11-19(18)27-22)25-21(28)13-29-20-7-2-1-4-15(20)12-24/h1-11H,13H2,(H,25,28)(H,26,27).
What are the key properties of 2-(2-cyanophenoxy)-N-[2-(3-fluorophenyl)-3H-benzimidazol-5-yl]acetamide?
2-(2-cyanophenoxy)-N-[2-(3-fluorophenyl)-3H-benzimidazol-5-yl]acetamide has a molecular weight of 386.39 g/mol, XLogP of 4.26, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyanophenoxy)-N-[2-(3-fluorophenyl)-3H-benzimidazol-5-yl]acetamide is sourced from PubChem (CID 55901129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).