N-[4-[2-(1H-benzimidazol-2-yl)phenoxy]phenyl]acetamide

C21H17N3O2 — CID 168555488

IUPACN-[4-[2-(1H-benzimidazol-2-yl)phenoxy]phenyl]acetamide
SMILESCC(=O)Nc1ccc(Oc2ccccc2-c2nc3ccccc3[nH]2)cc1
InChIInChI=1S/C21H17N3O2/c1-14(25)22-15-10-12-16(13-11-15)26-20-9-5-2-6-17(20)21-23-18-7-3-4-8-19(18)24-21/h2-13H,1H3,(H,22,25)(H,23,24)
InChIKeyTXURFEBWIBIZGU-UHFFFAOYSA-N
MW343.39 g/mol
LogP4.98
Rot. Bonds4

About N-[4-[2-(1H-benzimidazol-2-yl)phenoxy]phenyl]acetamide

N-[4-[2-(1H-benzimidazol-2-yl)phenoxy]phenyl]acetamide (PubChem CID 168555488) has the molecular formula C21H17N3O2 and a molecular weight of 343.39 g/mol. Its IUPAC name is N-[4-[2-(1H-benzimidazol-2-yl)phenoxy]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[2-(1H-benzimidazol-2-yl)phenoxy]phenyl]acetamide
PubChem CID168555488
Molecular FormulaC21H17N3O2
Molecular Weight343.39 g/mol
Exact Mass343.13
IUPAC NameN-[4-[2-(1H-benzimidazol-2-yl)phenoxy]phenyl]acetamide
SMILESCC(=O)Nc1ccc(Oc2ccccc2-c2nc3ccccc3[nH]2)cc1
InChIInChI=1S/C21H17N3O2/c1-14(25)22-15-10-12-16(13-11-15)26-20-9-5-2-6-17(20)21-23-18-7-3-4-8-19(18)24-21/h2-13H,1H3,(H,22,25)(H,23,24)
InChIKeyTXURFEBWIBIZGU-UHFFFAOYSA-N
XLogP4.98
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.39
LogP ≤ 54.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(1H-benzimidazol-2-yl)phenyl]acetamide
CID 5137262
N-[2-[2-(6-fluoro-1H-benzimidazol-2-yl)phenyl]-3H-benzimidazol-5-yl]acetamide
CID 10000153
2-[2-(3-tert-butylphenoxy)phenyl]-1H-benzimidazole
CID 168555310
N-[4-(2-aminophenoxy)phenyl]acetamide
CID 101461419
N-[2-(6-methoxy-1H-benzimidazol-2-yl)phenyl]acetamide
CID 18984570
(2S)-N-[4-(1H-benzimidazol-2-yl)phenyl]-2-phenoxypropanamide
CID 1365329
2-[2-[5-[2-(1H-benzimidazol-2-yl)phenoxy]pentoxy]phenyl]-1H-benzimidazole
CID 25255578
[1-(3,5-dimethoxyanilino)-1-oxopropan-2-yl] 2-(1H-benzimidazol-2-yl)benzoate
CID 23999646
N-(4-quinoxalin-2-yloxyphenyl)acetamide
CID 1473207
3-[4-(1H-benzimidazol-2-yl)phenoxy]-4-[2-[4-(1H-benzimidazol-2-yl)phenoxy]-4-hydroxyphenyl]phenol
CID 122211363
N-[4-[5-(1H-benzimidazol-2-yl)furan-2-yl]sulfonylphenyl]acetamide
CID 24832136
5-(1H-benzimidazol-2-yl)-N-(4-methoxyphenyl)-2,4-dimethyl-1H-pyrrole-3-carboxamide
CID 163360725

Frequently Asked Questions

What is the IUPAC name of N-[4-[2-(1H-benzimidazol-2-yl)phenoxy]phenyl]acetamide?
The IUPAC name of N-[4-[2-(1H-benzimidazol-2-yl)phenoxy]phenyl]acetamide (CID 168555488) is N-[4-[2-(1H-benzimidazol-2-yl)phenoxy]phenyl]acetamide.
What is the SMILES notation for N-[4-[2-(1H-benzimidazol-2-yl)phenoxy]phenyl]acetamide?
The canonical SMILES for N-[4-[2-(1H-benzimidazol-2-yl)phenoxy]phenyl]acetamide is CC(=O)Nc1ccc(Oc2ccccc2-c2nc3ccccc3[nH]2)cc1.
What is the InChIKey of N-[4-[2-(1H-benzimidazol-2-yl)phenoxy]phenyl]acetamide?
The InChIKey is TXURFEBWIBIZGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17N3O2/c1-14(25)22-15-10-12-16(13-11-15)26-20-9-5-2-6-17(20)21-23-18-7-3-4-8-19(18)24-21/h2-13H,1H3,(H,22,25)(H,23,24).
What are the key properties of N-[4-[2-(1H-benzimidazol-2-yl)phenoxy]phenyl]acetamide?
N-[4-[2-(1H-benzimidazol-2-yl)phenoxy]phenyl]acetamide has a molecular weight of 343.39 g/mol, XLogP of 4.98, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[2-(1H-benzimidazol-2-yl)phenoxy]phenyl]acetamide is sourced from PubChem (CID 168555488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).