N-[2-[1-[2-oxo-2-(1-phenylethylamino)ethyl]benzimidazol-2-yl]ethyl]benzamide

C26H26N4O2 — CID 17030691

IUPACN-[2-[1-[2-oxo-2-(1-phenylethylamino)ethyl]benzimidazol-2-yl]ethyl]benzamide
SMILESCC(NC(=O)Cn1c(CCNC(=O)c2ccccc2)nc2ccccc21)c1ccccc1
InChIInChI=1S/C26H26N4O2/c1-19(20-10-4-2-5-11-20)28-25(31)18-30-23-15-9-8-14-22(23)29-24(30)16-17-27-26(32)21-12-6-3-7-13-21/h2-15,19H,16-18H2,1H3,(H,27,32)(H,28,31)
InChIKeyOPJNGBTZNBZNBF-UHFFFAOYSA-N
MW426.52 g/mol
LogP3.89
Rot. Bonds8

About N-[2-[1-[2-oxo-2-(1-phenylethylamino)ethyl]benzimidazol-2-yl]ethyl]benzamide

N-[2-[1-[2-oxo-2-(1-phenylethylamino)ethyl]benzimidazol-2-yl]ethyl]benzamide (PubChem CID 17030691) has the molecular formula C26H26N4O2 and a molecular weight of 426.52 g/mol. Its IUPAC name is N-[2-[1-[2-oxo-2-(1-phenylethylamino)ethyl]benzimidazol-2-yl]ethyl]benzamide.

Molecular Properties

Compound NameN-[2-[1-[2-oxo-2-(1-phenylethylamino)ethyl]benzimidazol-2-yl]ethyl]benzamide
PubChem CID17030691
Molecular FormulaC26H26N4O2
Molecular Weight426.52 g/mol
Exact Mass426.21
IUPAC NameN-[2-[1-[2-oxo-2-(1-phenylethylamino)ethyl]benzimidazol-2-yl]ethyl]benzamide
SMILESCC(NC(=O)Cn1c(CCNC(=O)c2ccccc2)nc2ccccc21)c1ccccc1
InChIInChI=1S/C26H26N4O2/c1-19(20-10-4-2-5-11-20)28-25(31)18-30-23-15-9-8-14-22(23)29-24(30)16-17-27-26(32)21-12-6-3-7-13-21/h2-15,19H,16-18H2,1H3,(H,27,32)(H,28,31)
InChIKeyOPJNGBTZNBZNBF-UHFFFAOYSA-N
XLogP3.89
TPSA76.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500426.52
LogP ≤ 53.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-[1-[2-(butylamino)-2-oxoethyl]benzimidazol-2-yl]ethyl]benzamide
CID 17030651
2-[2-[3-[(2-methoxyacetyl)amino]propyl]benzimidazol-1-yl]-N-(1-phenylethyl)acetamide
CID 17031181
2-methyl-N-[[1-[2-oxo-2-(1-phenylethylamino)ethyl]benzimidazol-2-yl]methyl]propanamide
CID 17029092
3-methyl-N-[2-[1-[2-(2-methylpropylamino)-2-oxoethyl]benzimidazol-2-yl]ethyl]benzamide
CID 17030797
2-[2-(methoxymethyl)benzimidazol-1-yl]-N-(1-phenylethyl)acetamide
CID 17028848
N-[2-[1-[2-(4-ethylanilino)-2-oxoethyl]benzimidazol-2-yl]ethyl]benzamide
CID 17030679
2-[2-[(2-methylphenyl)methyl]benzimidazol-1-yl]-N-(1-phenylethyl)acetamide
CID 17032419
4-methyl-N-[2-[1-[2-oxo-2-(propylamino)ethyl]benzimidazol-2-yl]ethyl]benzamide
CID 17030844
N-[2-[1-(2-hydroxy-2-methylpropyl)benzimidazol-2-yl]ethyl]benzamide
CID 110932441
N-[2-[1-[(4-butan-2-ylphenyl)methyl]benzimidazol-2-yl]ethyl]benzamide
CID 16975742
N-[2-[1-(2-anilino-2-oxoethyl)benzimidazol-2-yl]ethyl]-4-chlorobenzamide
CID 17030906
N-[2-(1-undecylbenzimidazol-2-yl)ethyl]benzamide
CID 16975728

Frequently Asked Questions

What is the IUPAC name of N-[2-[1-[2-oxo-2-(1-phenylethylamino)ethyl]benzimidazol-2-yl]ethyl]benzamide?
The IUPAC name of N-[2-[1-[2-oxo-2-(1-phenylethylamino)ethyl]benzimidazol-2-yl]ethyl]benzamide (CID 17030691) is N-[2-[1-[2-oxo-2-(1-phenylethylamino)ethyl]benzimidazol-2-yl]ethyl]benzamide.
What is the SMILES notation for N-[2-[1-[2-oxo-2-(1-phenylethylamino)ethyl]benzimidazol-2-yl]ethyl]benzamide?
The canonical SMILES for N-[2-[1-[2-oxo-2-(1-phenylethylamino)ethyl]benzimidazol-2-yl]ethyl]benzamide is CC(NC(=O)Cn1c(CCNC(=O)c2ccccc2)nc2ccccc21)c1ccccc1.
What is the InChIKey of N-[2-[1-[2-oxo-2-(1-phenylethylamino)ethyl]benzimidazol-2-yl]ethyl]benzamide?
The InChIKey is OPJNGBTZNBZNBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H26N4O2/c1-19(20-10-4-2-5-11-20)28-25(31)18-30-23-15-9-8-14-22(23)29-24(30)16-17-27-26(32)21-12-6-3-7-13-21/h2-15,19H,16-18H2,1H3,(H,27,32)(H,28,31).
What are the key properties of N-[2-[1-[2-oxo-2-(1-phenylethylamino)ethyl]benzimidazol-2-yl]ethyl]benzamide?
N-[2-[1-[2-oxo-2-(1-phenylethylamino)ethyl]benzimidazol-2-yl]ethyl]benzamide has a molecular weight of 426.52 g/mol, XLogP of 3.89, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[1-[2-oxo-2-(1-phenylethylamino)ethyl]benzimidazol-2-yl]ethyl]benzamide is sourced from PubChem (CID 17030691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).