N-[(1R)-1-(1-benzoylbenzimidazol-2-yl)ethyl]benzamide

C23H19N3O2 — CID 71482011

IUPACN-[(1R)-1-(1-benzoylbenzimidazol-2-yl)ethyl]benzamide
SMILESC[C@@H](NC(=O)c1ccccc1)c1nc2ccccc2n1C(=O)c1ccccc1
InChIInChI=1S/C23H19N3O2/c1-16(24-22(27)17-10-4-2-5-11-17)21-25-19-14-8-9-15-20(19)26(21)23(28)18-12-6-3-7-13-18/h2-16H,1H3,(H,24,27)/t16-/m1/s1
InChIKeyJAWLFFYEIVFAOD-MRXNPFEDSA-N
MW369.42 g/mol
LogP4.22
Rot. Bonds4

About N-[(1R)-1-(1-benzoylbenzimidazol-2-yl)ethyl]benzamide

N-[(1R)-1-(1-benzoylbenzimidazol-2-yl)ethyl]benzamide (PubChem CID 71482011) has the molecular formula C23H19N3O2 and a molecular weight of 369.42 g/mol. Its IUPAC name is N-[(1R)-1-(1-benzoylbenzimidazol-2-yl)ethyl]benzamide.

Molecular Properties

Compound NameN-[(1R)-1-(1-benzoylbenzimidazol-2-yl)ethyl]benzamide
PubChem CID71482011
Molecular FormulaC23H19N3O2
Molecular Weight369.42 g/mol
Exact Mass369.15
IUPAC NameN-[(1R)-1-(1-benzoylbenzimidazol-2-yl)ethyl]benzamide
SMILESC[C@@H](NC(=O)c1ccccc1)c1nc2ccccc2n1C(=O)c1ccccc1
InChIInChI=1S/C23H19N3O2/c1-16(24-22(27)17-10-4-2-5-11-17)21-25-19-14-8-9-15-20(19)26(21)23(28)18-12-6-3-7-13-18/h2-16H,1H3,(H,24,27)/t16-/m1/s1
InChIKeyJAWLFFYEIVFAOD-MRXNPFEDSA-N
XLogP4.22
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.42
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(1S)-1-[1-(2-methylpropyl)benzimidazol-2-yl]ethyl]benzamide
CID 5400747
N-[1-[1-[2-oxo-2-(propan-2-ylamino)ethyl]benzimidazol-2-yl]ethyl]benzamide
CID 17029637
[(1S)-1-(1-benzoylbenzimidazol-2-yl)ethyl] acetate
CID 23582949
N-[1-[1-(difluoromethyl)benzimidazol-2-yl]ethyl]-4-(2-phenylethynyl)benzamide
CID 24597937
N-[1-[1-(2-methylprop-2-enyl)benzimidazol-2-yl]ethyl]benzamide
CID 4753696
N-[(1S)-1-(1-benzylbenzimidazol-2-yl)ethyl]-4-chlorobenzamide
CID 7007721
N-[1-[1-[(4-propan-2-ylphenyl)methyl]benzimidazol-2-yl]ethyl]benzamide
CID 16967343
N-[1-[1-[2-(azepan-1-yl)-2-oxoethyl]benzimidazol-2-yl]ethyl]benzamide
CID 16967444
N-[1-[1-[(2-chlorophenyl)methyl]benzimidazol-2-yl]ethyl]benzamide
CID 4754925
N-[1-(1-benzylbenzimidazol-2-yl)ethyl]-4-bromobenzamide
CID 17009321
N-[(1S)-1-[1-[(2,6-dichlorophenyl)methyl]benzimidazol-2-yl]ethyl]benzamide
CID 40910160
N-[1-[1-(2-anilino-2-oxoethyl)benzimidazol-2-yl]ethyl]benzamide
CID 3949916

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-(1-benzoylbenzimidazol-2-yl)ethyl]benzamide?
The IUPAC name of N-[(1R)-1-(1-benzoylbenzimidazol-2-yl)ethyl]benzamide (CID 71482011) is N-[(1R)-1-(1-benzoylbenzimidazol-2-yl)ethyl]benzamide.
What is the SMILES notation for N-[(1R)-1-(1-benzoylbenzimidazol-2-yl)ethyl]benzamide?
The canonical SMILES for N-[(1R)-1-(1-benzoylbenzimidazol-2-yl)ethyl]benzamide is C[C@@H](NC(=O)c1ccccc1)c1nc2ccccc2n1C(=O)c1ccccc1.
What is the InChIKey of N-[(1R)-1-(1-benzoylbenzimidazol-2-yl)ethyl]benzamide?
The InChIKey is JAWLFFYEIVFAOD-MRXNPFEDSA-N. The full InChI is InChI=1S/C23H19N3O2/c1-16(24-22(27)17-10-4-2-5-11-17)21-25-19-14-8-9-15-20(19)26(21)23(28)18-12-6-3-7-13-18/h2-16H,1H3,(H,24,27)/t16-/m1/s1.
What are the key properties of N-[(1R)-1-(1-benzoylbenzimidazol-2-yl)ethyl]benzamide?
N-[(1R)-1-(1-benzoylbenzimidazol-2-yl)ethyl]benzamide has a molecular weight of 369.42 g/mol, XLogP of 4.22, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-(1-benzoylbenzimidazol-2-yl)ethyl]benzamide is sourced from PubChem (CID 71482011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).