N-[2-[1-(2-phenylethyl)benzimidazol-2-yl]ethyl]formamide

C18H19N3O — CID 2992201

IUPACN-[2-[1-(2-phenylethyl)benzimidazol-2-yl]ethyl]formamide
SMILESO=CNCCc1nc2ccccc2n1CCc1ccccc1
InChIInChI=1S/C18H19N3O/c22-14-19-12-10-18-20-16-8-4-5-9-17(16)21(18)13-11-15-6-2-1-3-7-15/h1-9,14H,10-13H2,(H,19,22)
InChIKeyIMCKZAWPFMUGMD-UHFFFAOYSA-N
MW293.37 g/mol
LogP2.57
Rot. Bonds7

About N-[2-[1-(2-phenylethyl)benzimidazol-2-yl]ethyl]formamide

N-[2-[1-(2-phenylethyl)benzimidazol-2-yl]ethyl]formamide (PubChem CID 2992201) has the molecular formula C18H19N3O and a molecular weight of 293.37 g/mol. Its IUPAC name is N-[2-[1-(2-phenylethyl)benzimidazol-2-yl]ethyl]formamide.

Molecular Properties

Compound NameN-[2-[1-(2-phenylethyl)benzimidazol-2-yl]ethyl]formamide
PubChem CID2992201
Molecular FormulaC18H19N3O
Molecular Weight293.37 g/mol
Exact Mass293.15
IUPAC NameN-[2-[1-(2-phenylethyl)benzimidazol-2-yl]ethyl]formamide
SMILESO=CNCCc1nc2ccccc2n1CCc1ccccc1
InChIInChI=1S/C18H19N3O/c22-14-19-12-10-18-20-16-8-4-5-9-17(16)21(18)13-11-15-6-2-1-3-7-15/h1-9,14H,10-13H2,(H,19,22)
InChIKeyIMCKZAWPFMUGMD-UHFFFAOYSA-N
XLogP2.57
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-[2-[1-(2-phenylethyl)benzimidazol-2-yl]ethyl]formamide 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-[(2-chlorophenyl)methyl]benzimidazol-2-yl]ethyl]formamide
CID 2992540
3-phenyl-N-[2-[1-(2-phenylethyl)benzimidazol-2-yl]ethyl]propanamide
CID 16978263
N-[2-(2-aminobenzimidazol-1-yl)ethyl]formamide
CID 87838534
2-(2-phenylethyl)-1-propylbenzimidazole
CID 969694
3-[2-(2-phenylethyl)benzimidazol-1-yl]propanoic acid
CID 82144764
N-[5-[1-(3-phenylpropyl)benzimidazol-2-yl]pentyl]prop-2-enamide
CID 16992231
2-methyl-N-[2-[1-(3-phenylpropyl)benzimidazol-2-yl]ethyl]prop-2-enamide
CID 16980409
methane;N-(2-phenylethyl)formamide
CID 143644399
N-[(1-butylbenzimidazol-2-yl)methyl]-2-phenylethanamine
CID 134084304
2-amino-N-hydroxy-4-[1-(2-phenylethyl)benzimidazol-2-yl]butanamide
CID 23148423
N-[3-[1-[4-(2-methylphenoxy)butyl]benzimidazol-2-yl]propyl]formamide;hydrochloride
CID 22696615
2-(2-methylphenyl)-N-[5-[1-(2-phenylethyl)benzimidazol-2-yl]pentyl]acetamide
CID 16993525

Frequently Asked Questions

What is the IUPAC name of N-[2-[1-(2-phenylethyl)benzimidazol-2-yl]ethyl]formamide?
The IUPAC name of N-[2-[1-(2-phenylethyl)benzimidazol-2-yl]ethyl]formamide (CID 2992201) is N-[2-[1-(2-phenylethyl)benzimidazol-2-yl]ethyl]formamide.
What is the SMILES notation for N-[2-[1-(2-phenylethyl)benzimidazol-2-yl]ethyl]formamide?
The canonical SMILES for N-[2-[1-(2-phenylethyl)benzimidazol-2-yl]ethyl]formamide is O=CNCCc1nc2ccccc2n1CCc1ccccc1.
What is the InChIKey of N-[2-[1-(2-phenylethyl)benzimidazol-2-yl]ethyl]formamide?
The InChIKey is IMCKZAWPFMUGMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O/c22-14-19-12-10-18-20-16-8-4-5-9-17(16)21(18)13-11-15-6-2-1-3-7-15/h1-9,14H,10-13H2,(H,19,22).
What are the key properties of N-[2-[1-(2-phenylethyl)benzimidazol-2-yl]ethyl]formamide?
N-[2-[1-(2-phenylethyl)benzimidazol-2-yl]ethyl]formamide has a molecular weight of 293.37 g/mol, XLogP of 2.57, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[1-(2-phenylethyl)benzimidazol-2-yl]ethyl]formamide is sourced from PubChem (CID 2992201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).