2-(4-acetylphenoxy)-N-[6-(benzimidazol-1-yl)-3-pyridinyl]acetamide

C22H18N4O3 — CID 134004763

IUPAC2-(4-acetylphenoxy)-N-[6-(benzimidazol-1-yl)-3-pyridinyl]acetamide
SMILESCC(=O)c1ccc(OCC(=O)Nc2ccc(-n3cnc4ccccc43)nc2)cc1
InChIInChI=1S/C22H18N4O3/c1-15(27)16-6-9-18(10-7-16)29-13-22(28)25-17-8-11-21(23-12-17)26-14-24-19-4-2-3-5-20(19)26/h2-12,14H,13H2,1H3,(H,25,28)
InChIKeyUOEMPMKWHPTZMH-UHFFFAOYSA-N
MW386.41 g/mol
LogP3.64
Rot. Bonds6

About 2-(4-acetylphenoxy)-N-[6-(benzimidazol-1-yl)-3-pyridinyl]acetamide

2-(4-acetylphenoxy)-N-[6-(benzimidazol-1-yl)-3-pyridinyl]acetamide (PubChem CID 134004763) has the molecular formula C22H18N4O3 and a molecular weight of 386.41 g/mol. Its IUPAC name is 2-(4-acetylphenoxy)-N-[6-(benzimidazol-1-yl)-3-pyridinyl]acetamide.

Molecular Properties

Compound Name2-(4-acetylphenoxy)-N-[6-(benzimidazol-1-yl)-3-pyridinyl]acetamide
PubChem CID134004763
Molecular FormulaC22H18N4O3
Molecular Weight386.41 g/mol
Exact Mass386.14
IUPAC Name2-(4-acetylphenoxy)-N-[6-(benzimidazol-1-yl)-3-pyridinyl]acetamide
SMILESCC(=O)c1ccc(OCC(=O)Nc2ccc(-n3cnc4ccccc43)nc2)cc1
InChIInChI=1S/C22H18N4O3/c1-15(27)16-6-9-18(10-7-16)29-13-22(28)25-17-8-11-21(23-12-17)26-14-24-19-4-2-3-5-20(19)26/h2-12,14H,13H2,1H3,(H,25,28)
InChIKeyUOEMPMKWHPTZMH-UHFFFAOYSA-N
XLogP3.64
TPSA86.11 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.41
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[6-(benzimidazol-1-yl)-3-pyridinyl]pentanamide
CID 134004728
N-[6-(benzimidazol-1-yl)-3-pyridinyl]-4-(4-bromophenyl)-4-oxobutanamide
CID 56532152
N-[6-(benzimidazol-1-yl)-3-pyridinyl]-2-(3,4-dimethoxyphenyl)acetamide
CID 134004746
methyl 6-(benzimidazol-1-yl)pyridine-3-carboxylate
CID 4298771
N-[6-(benzimidazol-1-yl)-3-pyridinyl]-2-[(1S)-cyclopent-2-en-1-yl]acetamide
CID 51935910
N-[6-(benzimidazol-1-yl)-3-pyridinyl]-2-(1,3-benzoxazol-2-ylsulfanyl)acetamide
CID 55632014
2-amino-N-[6-(benzimidazol-1-yl)-3-pyridinyl]-2-methylpentanamide;dihydrochloride
CID 119850830
6-(benzimidazol-1-yl)pyridine-3-carboxamide
CID 90958614
2-(4-acetylphenoxy)-N-[4-(cyanomethoxy)phenyl]acetamide
CID 30873439
N-(4-acetylphenyl)-2-pyridin-3-yloxyacetamide
CID 110487947
tert-butyl 4-[[6-(benzimidazol-1-yl)-3-pyridinyl]carbamoyl]piperidine-1-carboxylate
CID 56532103
methyl (3R)-3-[[6-(benzimidazol-1-yl)-3-pyridinyl]carbamoylamino]-4-methoxy-3-methylbutanoate
CID 96534680

Frequently Asked Questions

What is the IUPAC name of 2-(4-acetylphenoxy)-N-[6-(benzimidazol-1-yl)-3-pyridinyl]acetamide?
The IUPAC name of 2-(4-acetylphenoxy)-N-[6-(benzimidazol-1-yl)-3-pyridinyl]acetamide (CID 134004763) is 2-(4-acetylphenoxy)-N-[6-(benzimidazol-1-yl)-3-pyridinyl]acetamide.
What is the SMILES notation for 2-(4-acetylphenoxy)-N-[6-(benzimidazol-1-yl)-3-pyridinyl]acetamide?
The canonical SMILES for 2-(4-acetylphenoxy)-N-[6-(benzimidazol-1-yl)-3-pyridinyl]acetamide is CC(=O)c1ccc(OCC(=O)Nc2ccc(-n3cnc4ccccc43)nc2)cc1.
What is the InChIKey of 2-(4-acetylphenoxy)-N-[6-(benzimidazol-1-yl)-3-pyridinyl]acetamide?
The InChIKey is UOEMPMKWHPTZMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N4O3/c1-15(27)16-6-9-18(10-7-16)29-13-22(28)25-17-8-11-21(23-12-17)26-14-24-19-4-2-3-5-20(19)26/h2-12,14H,13H2,1H3,(H,25,28).
What are the key properties of 2-(4-acetylphenoxy)-N-[6-(benzimidazol-1-yl)-3-pyridinyl]acetamide?
2-(4-acetylphenoxy)-N-[6-(benzimidazol-1-yl)-3-pyridinyl]acetamide has a molecular weight of 386.41 g/mol, XLogP of 3.64, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-acetylphenoxy)-N-[6-(benzimidazol-1-yl)-3-pyridinyl]acetamide is sourced from PubChem (CID 134004763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).