N-[2-[2-(6-fluoro-1H-benzimidazol-2-yl)phenyl]-3H-benzimidazol-5-yl]acetamide

C22H16FN5O — CID 10000153

IUPACN-[2-[2-(6-fluoro-1H-benzimidazol-2-yl)phenyl]-3H-benzimidazol-5-yl]acetamide
SMILESCC(=O)Nc1ccc2nc(-c3ccccc3-c3nc4ccc(F)cc4[nH]3)[nH]c2c1
InChIInChI=1S/C22H16FN5O/c1-12(29)24-14-7-9-18-20(11-14)28-22(26-18)16-5-3-2-4-15(16)21-25-17-8-6-13(23)10-19(17)27-21/h2-11H,1H3,(H,24,29)(H,25,27)(H,26,28)
InChIKeyKVOXUSYEIRKQLD-UHFFFAOYSA-N
MW385.40 g/mol
LogP4.87
Rot. Bonds3

About N-[2-[2-(6-fluoro-1H-benzimidazol-2-yl)phenyl]-3H-benzimidazol-5-yl]acetamide

N-[2-[2-(6-fluoro-1H-benzimidazol-2-yl)phenyl]-3H-benzimidazol-5-yl]acetamide (PubChem CID 10000153) has the molecular formula C22H16FN5O and a molecular weight of 385.40 g/mol. Its IUPAC name is N-[2-[2-(6-fluoro-1H-benzimidazol-2-yl)phenyl]-3H-benzimidazol-5-yl]acetamide.

Molecular Properties

Compound NameN-[2-[2-(6-fluoro-1H-benzimidazol-2-yl)phenyl]-3H-benzimidazol-5-yl]acetamide
PubChem CID10000153
Molecular FormulaC22H16FN5O
Molecular Weight385.40 g/mol
Exact Mass385.13
IUPAC NameN-[2-[2-(6-fluoro-1H-benzimidazol-2-yl)phenyl]-3H-benzimidazol-5-yl]acetamide
SMILESCC(=O)Nc1ccc2nc(-c3ccccc3-c3nc4ccc(F)cc4[nH]3)[nH]c2c1
InChIInChI=1S/C22H16FN5O/c1-12(29)24-14-7-9-18-20(11-14)28-22(26-18)16-5-3-2-4-15(16)21-25-17-8-6-13(23)10-19(17)27-21/h2-11H,1H3,(H,24,29)(H,25,27)(H,26,28)
InChIKeyKVOXUSYEIRKQLD-UHFFFAOYSA-N
XLogP4.87
TPSA86.46 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.40
LogP ≤ 54.87
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-[2-[6-(2,2-dimethylpropanoylamino)-1H-benzimidazol-2-yl]phenyl]-3H-benzimidazol-5-yl]-2,2-dimethylpropanamide
CID 10413942
N-[2-(3,5-diacetamidophenyl)-3H-benzimidazol-5-yl]acetamide
CID 1136428
N-[2-(2,5-difluorophenyl)-3H-benzimidazol-5-yl]pyridine-4-carboxamide
CID 47066056
N-[2-(2,5-difluorophenyl)-3H-benzimidazol-5-yl]-2-(1-methylidene-3-oxoisoindol-2-yl)acetamide
CID 55933918
N-[4-[2-(1H-benzimidazol-2-yl)phenoxy]phenyl]acetamide
CID 168555488
N-[2-(2-bromophenyl)-3H-benzimidazol-5-yl]-2-methoxyprop-2-enamide
CID 174278444
4-(6-fluoro-1H-benzimidazol-2-yl)fluoren-9-one
CID 59208169
N-[2-(2,5-difluorophenyl)-3H-benzimidazol-5-yl]-1-methyl-2-oxopyridine-4-carboxamide
CID 55933923
3-fluoro-N-(2-pyridin-2-yl-3H-benzimidazol-5-yl)benzamide
CID 56762590
N-[2-(3-fluorophenyl)-3H-benzimidazol-5-yl]-2-methylbutanamide
CID 60534062
N-[2-(2,5-difluorophenyl)-3H-benzimidazol-5-yl]-2-[2-oxo-2-(propan-2-ylamino)ethyl]sulfanylbenzamide
CID 55971085
N-[4-hydroxy-3-[6-(2-methylprop-2-enoylamino)-1H-benzimidazol-2-yl]phenyl]-2-methylprop-2-enamide
CID 3091491

Frequently Asked Questions

What is the IUPAC name of N-[2-[2-(6-fluoro-1H-benzimidazol-2-yl)phenyl]-3H-benzimidazol-5-yl]acetamide?
The IUPAC name of N-[2-[2-(6-fluoro-1H-benzimidazol-2-yl)phenyl]-3H-benzimidazol-5-yl]acetamide (CID 10000153) is N-[2-[2-(6-fluoro-1H-benzimidazol-2-yl)phenyl]-3H-benzimidazol-5-yl]acetamide.
What is the SMILES notation for N-[2-[2-(6-fluoro-1H-benzimidazol-2-yl)phenyl]-3H-benzimidazol-5-yl]acetamide?
The canonical SMILES for N-[2-[2-(6-fluoro-1H-benzimidazol-2-yl)phenyl]-3H-benzimidazol-5-yl]acetamide is CC(=O)Nc1ccc2nc(-c3ccccc3-c3nc4ccc(F)cc4[nH]3)[nH]c2c1.
What is the InChIKey of N-[2-[2-(6-fluoro-1H-benzimidazol-2-yl)phenyl]-3H-benzimidazol-5-yl]acetamide?
The InChIKey is KVOXUSYEIRKQLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H16FN5O/c1-12(29)24-14-7-9-18-20(11-14)28-22(26-18)16-5-3-2-4-15(16)21-25-17-8-6-13(23)10-19(17)27-21/h2-11H,1H3,(H,24,29)(H,25,27)(H,26,28).
What are the key properties of N-[2-[2-(6-fluoro-1H-benzimidazol-2-yl)phenyl]-3H-benzimidazol-5-yl]acetamide?
N-[2-[2-(6-fluoro-1H-benzimidazol-2-yl)phenyl]-3H-benzimidazol-5-yl]acetamide has a molecular weight of 385.40 g/mol, XLogP of 4.87, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-(6-fluoro-1H-benzimidazol-2-yl)phenyl]-3H-benzimidazol-5-yl]acetamide is sourced from PubChem (CID 10000153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).