2-[6-[(4-fluorophenyl)methoxy]-1H-benzimidazol-2-yl]acetamide

C16H14FN3O2 — CID 172638511

IUPAC2-[6-[(4-fluorophenyl)methoxy]-1H-benzimidazol-2-yl]acetamide
SMILESNC(=O)Cc1nc2ccc(OCc3ccc(F)cc3)cc2[nH]1
InChIInChI=1S/C16H14FN3O2/c17-11-3-1-10(2-4-11)9-22-12-5-6-13-14(7-12)20-16(19-13)8-15(18)21/h1-7H,8-9H2,(H2,18,21)(H,19,20)
InChIKeyAOGHVXHSPZUBKO-UHFFFAOYSA-N
MW299.31 g/mol
LogP2.31
Rot. Bonds5

About 2-[6-[(4-fluorophenyl)methoxy]-1H-benzimidazol-2-yl]acetamide

2-[6-[(4-fluorophenyl)methoxy]-1H-benzimidazol-2-yl]acetamide (PubChem CID 172638511) has the molecular formula C16H14FN3O2 and a molecular weight of 299.31 g/mol. Its IUPAC name is 2-[6-[(4-fluorophenyl)methoxy]-1H-benzimidazol-2-yl]acetamide.

Molecular Properties

Compound Name2-[6-[(4-fluorophenyl)methoxy]-1H-benzimidazol-2-yl]acetamide
PubChem CID172638511
Molecular FormulaC16H14FN3O2
Molecular Weight299.31 g/mol
Exact Mass299.11
IUPAC Name2-[6-[(4-fluorophenyl)methoxy]-1H-benzimidazol-2-yl]acetamide
SMILESNC(=O)Cc1nc2ccc(OCc3ccc(F)cc3)cc2[nH]1
InChIInChI=1S/C16H14FN3O2/c17-11-3-1-10(2-4-11)9-22-12-5-6-13-14(7-12)20-16(19-13)8-15(18)21/h1-7H,8-9H2,(H2,18,21)(H,19,20)
InChIKeyAOGHVXHSPZUBKO-UHFFFAOYSA-N
XLogP2.31
TPSA81.00 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.31
LogP ≤ 52.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-[6-[(4-fluorophenyl)methoxy]-1H-benzimidazol-2-yl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[6-[[4-(trifluoromethyl)phenyl]methoxy]-1H-benzimidazol-2-yl]acetamide
CID 177377064
6-fluoro-2-[(4-fluorophenoxy)methyl]-1H-benzimidazole
CID 23613775
2-(6-ethoxy-1H-benzimidazol-2-yl)acetic acid
CID 82331853
3-[(4-fluorophenyl)methoxy]benzamide
CID 18354605
3-[4-[(4-fluorophenyl)methoxy]phenyl]propanamide
CID 91686884
2-fluoro-4-[(4-fluorophenyl)methoxy]benzaldehyde
CID 89250965
3-(6-phenylmethoxy-1H-benzimidazol-2-yl)benzamide
CID 4915123
6-ethoxy-2-[1-[4-[(4-fluorophenyl)methoxy]phenyl]ethyl]-1H-benzimidazole
CID 89433744
4-[(4-fluorophenyl)methoxy]-1-[2-(3,3,3-trifluoropropyl)-3H-benzimidazol-5-yl]pyridin-2-one
CID 123504976
2-[(4-fluorophenyl)methyl]-3H-benzimidazol-5-ol
CID 81431671
N-[4-(2-amino-2-oxoethyl)phenyl]-3-[(4-fluorophenyl)methoxy]benzamide
CID 31857522
2-[(2-ethyl-3H-benzimidazol-5-yl)oxymethyl]benzoic acid
CID 84816254

Frequently Asked Questions

What is the IUPAC name of 2-[6-[(4-fluorophenyl)methoxy]-1H-benzimidazol-2-yl]acetamide?
The IUPAC name of 2-[6-[(4-fluorophenyl)methoxy]-1H-benzimidazol-2-yl]acetamide (CID 172638511) is 2-[6-[(4-fluorophenyl)methoxy]-1H-benzimidazol-2-yl]acetamide.
What is the SMILES notation for 2-[6-[(4-fluorophenyl)methoxy]-1H-benzimidazol-2-yl]acetamide?
The canonical SMILES for 2-[6-[(4-fluorophenyl)methoxy]-1H-benzimidazol-2-yl]acetamide is NC(=O)Cc1nc2ccc(OCc3ccc(F)cc3)cc2[nH]1.
What is the InChIKey of 2-[6-[(4-fluorophenyl)methoxy]-1H-benzimidazol-2-yl]acetamide?
The InChIKey is AOGHVXHSPZUBKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14FN3O2/c17-11-3-1-10(2-4-11)9-22-12-5-6-13-14(7-12)20-16(19-13)8-15(18)21/h1-7H,8-9H2,(H2,18,21)(H,19,20).
What are the key properties of 2-[6-[(4-fluorophenyl)methoxy]-1H-benzimidazol-2-yl]acetamide?
2-[6-[(4-fluorophenyl)methoxy]-1H-benzimidazol-2-yl]acetamide has a molecular weight of 299.31 g/mol, XLogP of 2.31, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-[(4-fluorophenyl)methoxy]-1H-benzimidazol-2-yl]acetamide is sourced from PubChem (CID 172638511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).