N-[2-[1-(2-hydroxy-2-methylpropyl)benzimidazol-2-yl]ethyl]benzamide

C20H23N3O2 — CID 110932441

IUPACN-[2-[1-(2-hydroxy-2-methylpropyl)benzimidazol-2-yl]ethyl]benzamide
SMILESCC(C)(O)Cn1c(CCNC(=O)c2ccccc2)nc2ccccc21
InChIInChI=1S/C20H23N3O2/c1-20(2,25)14-23-17-11-7-6-10-16(17)22-18(23)12-13-21-19(24)15-8-4-3-5-9-15/h3-11,25H,12-14H2,1-2H3,(H,21,24)
InChIKeyBSWKJIPLJKPYQS-UHFFFAOYSA-N
MW337.42 g/mol
LogP2.78
Rot. Bonds6

About N-[2-[1-(2-hydroxy-2-methylpropyl)benzimidazol-2-yl]ethyl]benzamide

N-[2-[1-(2-hydroxy-2-methylpropyl)benzimidazol-2-yl]ethyl]benzamide (PubChem CID 110932441) has the molecular formula C20H23N3O2 and a molecular weight of 337.42 g/mol. Its IUPAC name is N-[2-[1-(2-hydroxy-2-methylpropyl)benzimidazol-2-yl]ethyl]benzamide.

Molecular Properties

Compound NameN-[2-[1-(2-hydroxy-2-methylpropyl)benzimidazol-2-yl]ethyl]benzamide
PubChem CID110932441
Molecular FormulaC20H23N3O2
Molecular Weight337.42 g/mol
Exact Mass337.18
IUPAC NameN-[2-[1-(2-hydroxy-2-methylpropyl)benzimidazol-2-yl]ethyl]benzamide
SMILESCC(C)(O)Cn1c(CCNC(=O)c2ccccc2)nc2ccccc21
InChIInChI=1S/C20H23N3O2/c1-20(2,25)14-23-17-11-7-6-10-16(17)22-18(23)12-13-21-19(24)15-8-4-3-5-9-15/h3-11,25H,12-14H2,1-2H3,(H,21,24)
InChIKeyBSWKJIPLJKPYQS-UHFFFAOYSA-N
XLogP2.78
TPSA67.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.42
LogP ≤ 52.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[2-[1-(2-hydroxy-2-methylpropyl)benzimidazol-2-yl]ethyl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[2-(1-undecylbenzimidazol-2-yl)ethyl]benzamide
CID 16975728
N-[2-[1-(3-amino-3-oxopropyl)benzimidazol-2-yl]ethyl]benzamide
CID 51532359
N-[2-[1-[3-(4-tert-butylphenoxy)propyl]benzimidazol-2-yl]ethyl]benzamide
CID 16975801
N-[2-[1-[2-(butylamino)-2-oxoethyl]benzimidazol-2-yl]ethyl]benzamide
CID 17030651
N-[2-[1-[(3,4-dichlorophenyl)methyl]benzimidazol-2-yl]ethyl]benzamide
CID 16975738
N-[5-(1-ethylbenzimidazol-2-yl)pentyl]benzamide
CID 16989267
N-[2-[1-[2-oxo-2-(1-phenylethylamino)ethyl]benzimidazol-2-yl]ethyl]benzamide
CID 17030691
N-[2-[1-[(4-tert-butylphenyl)methyl]benzimidazol-2-yl]ethyl]pyridine-4-carboxamide
CID 16965888
N-[2-(1-ethylbenzimidazol-2-yl)ethyl]-4-methoxybenzamide
CID 16976665
2-chloro-N-[2-(1-phenacylbenzimidazol-2-yl)ethyl]benzamide
CID 16976181
N-[3-(1-undecylbenzimidazol-2-yl)propyl]benzamide
CID 16982202
N-[3-[1-[(2,3,5,6-tetramethylphenyl)methyl]benzimidazol-2-yl]propyl]benzamide
CID 16982208

Frequently Asked Questions

What is the IUPAC name of N-[2-[1-(2-hydroxy-2-methylpropyl)benzimidazol-2-yl]ethyl]benzamide?
The IUPAC name of N-[2-[1-(2-hydroxy-2-methylpropyl)benzimidazol-2-yl]ethyl]benzamide (CID 110932441) is N-[2-[1-(2-hydroxy-2-methylpropyl)benzimidazol-2-yl]ethyl]benzamide.
What is the SMILES notation for N-[2-[1-(2-hydroxy-2-methylpropyl)benzimidazol-2-yl]ethyl]benzamide?
The canonical SMILES for N-[2-[1-(2-hydroxy-2-methylpropyl)benzimidazol-2-yl]ethyl]benzamide is CC(C)(O)Cn1c(CCNC(=O)c2ccccc2)nc2ccccc21.
What is the InChIKey of N-[2-[1-(2-hydroxy-2-methylpropyl)benzimidazol-2-yl]ethyl]benzamide?
The InChIKey is BSWKJIPLJKPYQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O2/c1-20(2,25)14-23-17-11-7-6-10-16(17)22-18(23)12-13-21-19(24)15-8-4-3-5-9-15/h3-11,25H,12-14H2,1-2H3,(H,21,24).
What are the key properties of N-[2-[1-(2-hydroxy-2-methylpropyl)benzimidazol-2-yl]ethyl]benzamide?
N-[2-[1-(2-hydroxy-2-methylpropyl)benzimidazol-2-yl]ethyl]benzamide has a molecular weight of 337.42 g/mol, XLogP of 2.78, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[1-(2-hydroxy-2-methylpropyl)benzimidazol-2-yl]ethyl]benzamide is sourced from PubChem (CID 110932441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).