N-(4-ethoxyphenyl)-2-(2-ethylbenzimidazol-1-yl)acetamide

C19H21N3O2 — CID 3460449

IUPACN-(4-ethoxyphenyl)-2-(2-ethylbenzimidazol-1-yl)acetamide
SMILESCCOc1ccc(NC(=O)Cn2c(CC)nc3ccccc32)cc1
InChIInChI=1S/C19H21N3O2/c1-3-18-21-16-7-5-6-8-17(16)22(18)13-19(23)20-14-9-11-15(12-10-14)24-4-2/h5-12H,3-4,13H2,1-2H3,(H,20,23)
InChIKeyKXZPKAXCWLGHJF-UHFFFAOYSA-N
MW323.40 g/mol
LogP3.64
Rot. Bonds6

About N-(4-ethoxyphenyl)-2-(2-ethylbenzimidazol-1-yl)acetamide

N-(4-ethoxyphenyl)-2-(2-ethylbenzimidazol-1-yl)acetamide (PubChem CID 3460449) has the molecular formula C19H21N3O2 and a molecular weight of 323.40 g/mol. Its IUPAC name is N-(4-ethoxyphenyl)-2-(2-ethylbenzimidazol-1-yl)acetamide.

Molecular Properties

Compound NameN-(4-ethoxyphenyl)-2-(2-ethylbenzimidazol-1-yl)acetamide
PubChem CID3460449
Molecular FormulaC19H21N3O2
Molecular Weight323.40 g/mol
Exact Mass323.16
IUPAC NameN-(4-ethoxyphenyl)-2-(2-ethylbenzimidazol-1-yl)acetamide
SMILESCCOc1ccc(NC(=O)Cn2c(CC)nc3ccccc32)cc1
InChIInChI=1S/C19H21N3O2/c1-3-18-21-16-7-5-6-8-17(16)22(18)13-19(23)20-14-9-11-15(12-10-14)24-4-2/h5-12H,3-4,13H2,1-2H3,(H,20,23)
InChIKeyKXZPKAXCWLGHJF-UHFFFAOYSA-N
XLogP3.64
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.40
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-ethoxyphenyl)-2-[2-(hydroxymethyl)benzimidazol-1-yl]acetamide
CID 78767015
2-(2-ethylbenzimidazol-1-yl)-N-[4-(2,2,2-trifluoroethoxy)phenyl]acetamide
CID 46674253
N-(4-ethoxyphenyl)-2-[2-(2-phenylethyl)benzimidazol-1-yl]acetamide
CID 17031709
N-(4-ethoxyphenyl)-2-[2-[(2-methylphenyl)methyl]benzimidazol-1-yl]acetamide
CID 17032408
N-(4-ethoxyphenyl)-2-[2-[[(2-methoxyacetyl)amino]methyl]benzimidazol-1-yl]acetamide
CID 17029032
2-(2-ethylbenzimidazol-1-yl)-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]acetamide
CID 55855526
N-(4-ethoxyphenyl)-2-[2-[(E)-2-phenylethenyl]benzimidazol-1-yl]acetamide
CID 17031751
N-[3-[1-[2-(4-ethoxyanilino)-2-oxoethyl]benzimidazol-2-yl]propyl]-4-methylbenzamide
CID 17031611
N-[[1-[2-(4-ethoxyanilino)-2-oxoethyl]benzimidazol-2-yl]methyl]oxolane-2-carboxamide
CID 17029228
3-[4-[2-(4-ethoxyanilino)-2-oxoethyl]-3-oxoquinoxalin-2-yl]-N-methylpropanamide
CID 53129317
2-[2-(hydroxymethyl)benzimidazol-1-yl]-N-(4-phenylmethoxyphenyl)acetamide
CID 99139728
N-[6-(diethylamino)-3-pyridinyl]-2-(2-ethylbenzimidazol-1-yl)acetamide
CID 55784403

Frequently Asked Questions

What is the IUPAC name of N-(4-ethoxyphenyl)-2-(2-ethylbenzimidazol-1-yl)acetamide?
The IUPAC name of N-(4-ethoxyphenyl)-2-(2-ethylbenzimidazol-1-yl)acetamide (CID 3460449) is N-(4-ethoxyphenyl)-2-(2-ethylbenzimidazol-1-yl)acetamide.
What is the SMILES notation for N-(4-ethoxyphenyl)-2-(2-ethylbenzimidazol-1-yl)acetamide?
The canonical SMILES for N-(4-ethoxyphenyl)-2-(2-ethylbenzimidazol-1-yl)acetamide is CCOc1ccc(NC(=O)Cn2c(CC)nc3ccccc32)cc1.
What is the InChIKey of N-(4-ethoxyphenyl)-2-(2-ethylbenzimidazol-1-yl)acetamide?
The InChIKey is KXZPKAXCWLGHJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O2/c1-3-18-21-16-7-5-6-8-17(16)22(18)13-19(23)20-14-9-11-15(12-10-14)24-4-2/h5-12H,3-4,13H2,1-2H3,(H,20,23).
What are the key properties of N-(4-ethoxyphenyl)-2-(2-ethylbenzimidazol-1-yl)acetamide?
N-(4-ethoxyphenyl)-2-(2-ethylbenzimidazol-1-yl)acetamide has a molecular weight of 323.40 g/mol, XLogP of 3.64, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethoxyphenyl)-2-(2-ethylbenzimidazol-1-yl)acetamide is sourced from PubChem (CID 3460449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).