N-(3-bromophenyl)-2-[2-(furan-2-yl)benzimidazol-1-yl]acetamide

C19H14BrN3O2 — CID 17033320

IUPACN-(3-bromophenyl)-2-[2-(furan-2-yl)benzimidazol-1-yl]acetamide
SMILESO=C(Cn1c(-c2ccco2)nc2ccccc21)Nc1cccc(Br)c1
InChIInChI=1S/C19H14BrN3O2/c20-13-5-3-6-14(11-13)21-18(24)12-23-16-8-2-1-7-15(16)22-19(23)17-9-4-10-25-17/h1-11H,12H2,(H,21,24)
InChIKeyCUQVFQWTJZTMFD-UHFFFAOYSA-N
MW396.24 g/mol
LogP4.70
Rot. Bonds4

About N-(3-bromophenyl)-2-[2-(furan-2-yl)benzimidazol-1-yl]acetamide

N-(3-bromophenyl)-2-[2-(furan-2-yl)benzimidazol-1-yl]acetamide (PubChem CID 17033320) has the molecular formula C19H14BrN3O2 and a molecular weight of 396.24 g/mol. Its IUPAC name is N-(3-bromophenyl)-2-[2-(furan-2-yl)benzimidazol-1-yl]acetamide.

Molecular Properties

Compound NameN-(3-bromophenyl)-2-[2-(furan-2-yl)benzimidazol-1-yl]acetamide
PubChem CID17033320
Molecular FormulaC19H14BrN3O2
Molecular Weight396.24 g/mol
Exact Mass395.03
IUPAC NameN-(3-bromophenyl)-2-[2-(furan-2-yl)benzimidazol-1-yl]acetamide
SMILESO=C(Cn1c(-c2ccco2)nc2ccccc21)Nc1cccc(Br)c1
InChIInChI=1S/C19H14BrN3O2/c20-13-5-3-6-14(11-13)21-18(24)12-23-16-8-2-1-7-15(16)22-19(23)17-9-4-10-25-17/h1-11H,12H2,(H,21,24)
InChIKeyCUQVFQWTJZTMFD-UHFFFAOYSA-N
XLogP4.70
TPSA60.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.24
LogP ≤ 54.70
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-(3-bromophenyl)-2-[[5-(furan-2-yl)-[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl]acetamide
CID 50755474
N-cyclopropyl-2-[2-(furan-2-yl)benzimidazol-1-yl]acetamide
CID 17033311
N-(3-bromophenyl)-2-[2-(methylsulfanylmethyl)benzimidazol-1-yl]acetamide
CID 40723945
N-(3-bromophenyl)-2-[2-(methylsulfonylmethyl)benzimidazol-1-yl]acetamide
CID 25334769
N-[(4-fluorophenyl)methyl]-2-[2-(furan-2-yl)benzimidazol-1-yl]acetamide
CID 17033340
N-(3-bromophenyl)-2-[2-[(2-methoxyphenoxy)methyl]benzimidazol-1-yl]acetamide
CID 17031923
N-(3-methoxyphenyl)-2-[2-(4-methylphenyl)benzimidazol-1-yl]acetamide
CID 17033082
1-(3-bromophenyl)-3-[2-(2-methylbenzimidazol-1-yl)ethyl]thiourea
CID 9237587
N-[2-[1-[2-(3-methoxyanilino)-2-oxoethyl]benzimidazol-2-yl]ethyl]furan-2-carboxamide
CID 17030625
2-[2-(3-bromophenyl)benzimidazol-1-yl]-N-propylacetamide
CID 17032863
N-(3-bromo-5-methylphenyl)-2-[2-(1,3-thiazol-5-yl)benzimidazol-1-yl]acetamide
CID 155812818

Frequently Asked Questions

What is the IUPAC name of N-(3-bromophenyl)-2-[2-(furan-2-yl)benzimidazol-1-yl]acetamide?
The IUPAC name of N-(3-bromophenyl)-2-[2-(furan-2-yl)benzimidazol-1-yl]acetamide (CID 17033320) is N-(3-bromophenyl)-2-[2-(furan-2-yl)benzimidazol-1-yl]acetamide.
What is the SMILES notation for N-(3-bromophenyl)-2-[2-(furan-2-yl)benzimidazol-1-yl]acetamide?
The canonical SMILES for N-(3-bromophenyl)-2-[2-(furan-2-yl)benzimidazol-1-yl]acetamide is O=C(Cn1c(-c2ccco2)nc2ccccc21)Nc1cccc(Br)c1.
What is the InChIKey of N-(3-bromophenyl)-2-[2-(furan-2-yl)benzimidazol-1-yl]acetamide?
The InChIKey is CUQVFQWTJZTMFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14BrN3O2/c20-13-5-3-6-14(11-13)21-18(24)12-23-16-8-2-1-7-15(16)22-19(23)17-9-4-10-25-17/h1-11H,12H2,(H,21,24).
What are the key properties of N-(3-bromophenyl)-2-[2-(furan-2-yl)benzimidazol-1-yl]acetamide?
N-(3-bromophenyl)-2-[2-(furan-2-yl)benzimidazol-1-yl]acetamide has a molecular weight of 396.24 g/mol, XLogP of 4.70, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-bromophenyl)-2-[2-(furan-2-yl)benzimidazol-1-yl]acetamide is sourced from PubChem (CID 17033320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).