N-[(4-fluorophenyl)methyl]-2-[2-(furan-2-yl)benzimidazol-1-yl]acetamide

C20H16FN3O2 — CID 17033340

IUPACN-[(4-fluorophenyl)methyl]-2-[2-(furan-2-yl)benzimidazol-1-yl]acetamide
SMILESO=C(Cn1c(-c2ccco2)nc2ccccc21)NCc1ccc(F)cc1
InChIInChI=1S/C20H16FN3O2/c21-15-9-7-14(8-10-15)12-22-19(25)13-24-17-5-2-1-4-16(17)23-20(24)18-6-3-11-26-18/h1-11H,12-13H2,(H,22,25)
InChIKeyXSJHPXXTQPZDIW-UHFFFAOYSA-N
MW349.37 g/mol
LogP3.75
Rot. Bonds5

About N-[(4-fluorophenyl)methyl]-2-[2-(furan-2-yl)benzimidazol-1-yl]acetamide

N-[(4-fluorophenyl)methyl]-2-[2-(furan-2-yl)benzimidazol-1-yl]acetamide (PubChem CID 17033340) has the molecular formula C20H16FN3O2 and a molecular weight of 349.37 g/mol. Its IUPAC name is N-[(4-fluorophenyl)methyl]-2-[2-(furan-2-yl)benzimidazol-1-yl]acetamide.

Molecular Properties

Compound NameN-[(4-fluorophenyl)methyl]-2-[2-(furan-2-yl)benzimidazol-1-yl]acetamide
PubChem CID17033340
Molecular FormulaC20H16FN3O2
Molecular Weight349.37 g/mol
Exact Mass349.12
IUPAC NameN-[(4-fluorophenyl)methyl]-2-[2-(furan-2-yl)benzimidazol-1-yl]acetamide
SMILESO=C(Cn1c(-c2ccco2)nc2ccccc21)NCc1ccc(F)cc1
InChIInChI=1S/C20H16FN3O2/c21-15-9-7-14(8-10-15)12-22-19(25)13-24-17-5-2-1-4-16(17)23-20(24)18-6-3-11-26-18/h1-11H,12-13H2,(H,22,25)
InChIKeyXSJHPXXTQPZDIW-UHFFFAOYSA-N
XLogP3.75
TPSA60.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.37
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-benzyl-2-[2-(furan-2-yl)benzimidazol-1-yl]acetamide
CID 863504
N-cyclopropyl-2-[2-(furan-2-yl)benzimidazol-1-yl]acetamide
CID 17033311
2-[2-(3,4-dimethoxyphenyl)benzimidazol-1-yl]-N-[(4-fluorophenyl)methyl]acetamide
CID 17033006
N-[(4-fluorophenyl)methyl]-2-[2-[[(2S)-2-hydroxypropyl]amino]benzimidazol-1-yl]acetamide
CID 92852670
N-[(4-fluorophenyl)methyl]-2-[2-(furan-2-yl)quinazolin-4-yl]sulfanylacetamide
CID 46679609
N-(3-bromophenyl)-2-[2-(furan-2-yl)benzimidazol-1-yl]acetamide
CID 17033320
N-ethyl-3-[4-[2-[(4-fluorophenyl)methylamino]-2-oxoethyl]-3-oxoquinoxalin-2-yl]propanamide
CID 53129237
N-benzyl-2-[2-(4-bromophenyl)benzimidazol-1-yl]acetamide
CID 17033248
2-[2-(4-bromophenyl)benzimidazol-1-yl]-N-[(4-methoxyphenyl)methyl]acetamide
CID 17033250
N-[(4-fluorophenyl)methyl]-2-[[2-(furan-2-yl)-[1,2,4]triazolo[1,5-c]quinazolin-5-yl]sulfanyl]acetamide
CID 71907012
N-(4-fluorophenyl)-2-(2-phenylbenzimidazol-1-yl)acetamide
CID 17032697
N-[(4-chlorophenyl)methyl]-2-(3-methyl-2-oxoquinoxalin-1-yl)acetamide
CID 46295466

Frequently Asked Questions

What is the IUPAC name of N-[(4-fluorophenyl)methyl]-2-[2-(furan-2-yl)benzimidazol-1-yl]acetamide?
The IUPAC name of N-[(4-fluorophenyl)methyl]-2-[2-(furan-2-yl)benzimidazol-1-yl]acetamide (CID 17033340) is N-[(4-fluorophenyl)methyl]-2-[2-(furan-2-yl)benzimidazol-1-yl]acetamide.
What is the SMILES notation for N-[(4-fluorophenyl)methyl]-2-[2-(furan-2-yl)benzimidazol-1-yl]acetamide?
The canonical SMILES for N-[(4-fluorophenyl)methyl]-2-[2-(furan-2-yl)benzimidazol-1-yl]acetamide is O=C(Cn1c(-c2ccco2)nc2ccccc21)NCc1ccc(F)cc1.
What is the InChIKey of N-[(4-fluorophenyl)methyl]-2-[2-(furan-2-yl)benzimidazol-1-yl]acetamide?
The InChIKey is XSJHPXXTQPZDIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16FN3O2/c21-15-9-7-14(8-10-15)12-22-19(25)13-24-17-5-2-1-4-16(17)23-20(24)18-6-3-11-26-18/h1-11H,12-13H2,(H,22,25).
What are the key properties of N-[(4-fluorophenyl)methyl]-2-[2-(furan-2-yl)benzimidazol-1-yl]acetamide?
N-[(4-fluorophenyl)methyl]-2-[2-(furan-2-yl)benzimidazol-1-yl]acetamide has a molecular weight of 349.37 g/mol, XLogP of 3.75, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-fluorophenyl)methyl]-2-[2-(furan-2-yl)benzimidazol-1-yl]acetamide is sourced from PubChem (CID 17033340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).