N-[[1-(3-naphthalen-2-yloxypropyl)benzimidazol-2-yl]methyl]acetamide

C23H23N3O2 — CID 17005978

IUPACN-[[1-(3-naphthalen-2-yloxypropyl)benzimidazol-2-yl]methyl]acetamide
SMILESCC(=O)NCc1nc2ccccc2n1CCCOc1ccc2ccccc2c1
InChIInChI=1S/C23H23N3O2/c1-17(27)24-16-23-25-21-9-4-5-10-22(21)26(23)13-6-14-28-20-12-11-18-7-2-3-8-19(18)15-20/h2-5,7-12,15H,6,13-14,16H2,1H3,(H,24,27)
InChIKeyWLZNWJQBZMHKGV-UHFFFAOYSA-N
MW373.46 g/mol
LogP4.29
Rot. Bonds7

About N-[[1-(3-naphthalen-2-yloxypropyl)benzimidazol-2-yl]methyl]acetamide

N-[[1-(3-naphthalen-2-yloxypropyl)benzimidazol-2-yl]methyl]acetamide (PubChem CID 17005978) has the molecular formula C23H23N3O2 and a molecular weight of 373.46 g/mol. Its IUPAC name is N-[[1-(3-naphthalen-2-yloxypropyl)benzimidazol-2-yl]methyl]acetamide.

Molecular Properties

Compound NameN-[[1-(3-naphthalen-2-yloxypropyl)benzimidazol-2-yl]methyl]acetamide
PubChem CID17005978
Molecular FormulaC23H23N3O2
Molecular Weight373.46 g/mol
Exact Mass373.18
IUPAC NameN-[[1-(3-naphthalen-2-yloxypropyl)benzimidazol-2-yl]methyl]acetamide
SMILESCC(=O)NCc1nc2ccccc2n1CCCOc1ccc2ccccc2c1
InChIInChI=1S/C23H23N3O2/c1-17(27)24-16-23-25-21-9-4-5-10-22(21)26(23)13-6-14-28-20-12-11-18-7-2-3-8-19(18)15-20/h2-5,7-12,15H,6,13-14,16H2,1H3,(H,24,27)
InChIKeyWLZNWJQBZMHKGV-UHFFFAOYSA-N
XLogP4.29
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.46
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N-[[1-(3-naphthalen-2-yloxypropyl)benzimidazol-2-yl]methyl]acetamide 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-[[1-[4-(3-methylphenoxy)butyl]benzimidazol-2-yl]methyl]acetamide
CID 17005993
N-[[1-[4-(4-tert-butylphenoxy)butyl]benzimidazol-2-yl]methyl]acetamide
CID 17006002
N-[[1-(2-phenoxyethyl)benzimidazol-2-yl]methyl]acetamide
CID 17005925
2-methyl-N-[2-[1-(3-naphthalen-2-yloxypropyl)benzimidazol-2-yl]ethyl]prop-2-enamide
CID 16980464
N-[(1-nonylbenzimidazol-2-yl)methyl]acetamide
CID 17005899
(Z)-N-[3-[1-(3-naphthalen-2-yloxypropyl)benzimidazol-2-yl]propyl]but-2-enamide
CID 16987123
2-methyl-N-[[1-(3-phenoxypropyl)benzimidazol-2-yl]methyl]propanamide
CID 17006257
2-(2-methylphenyl)-N-[5-[1-(3-naphthalen-2-yloxypropyl)benzimidazol-2-yl]pentyl]acetamide
CID 16993582
N-[[1-[4-(3,4-dimethylphenoxy)butyl]benzimidazol-2-yl]methyl]-2,2-dimethylpropanamide
CID 16969570
N-[[1-[3-(dimethylamino)propyl]benzimidazol-2-yl]methyl]acetamide
CID 52904872
N-[[1-(2-naphthalen-1-yloxyethyl)benzimidazol-2-yl]methyl]acetamide
CID 17005950
2-[(4-methoxyphenyl)methyl]-1-(3-naphthalen-2-yloxypropyl)benzimidazole
CID 18879090

Frequently Asked Questions

What is the IUPAC name of N-[[1-(3-naphthalen-2-yloxypropyl)benzimidazol-2-yl]methyl]acetamide?
The IUPAC name of N-[[1-(3-naphthalen-2-yloxypropyl)benzimidazol-2-yl]methyl]acetamide (CID 17005978) is N-[[1-(3-naphthalen-2-yloxypropyl)benzimidazol-2-yl]methyl]acetamide.
What is the SMILES notation for N-[[1-(3-naphthalen-2-yloxypropyl)benzimidazol-2-yl]methyl]acetamide?
The canonical SMILES for N-[[1-(3-naphthalen-2-yloxypropyl)benzimidazol-2-yl]methyl]acetamide is CC(=O)NCc1nc2ccccc2n1CCCOc1ccc2ccccc2c1.
What is the InChIKey of N-[[1-(3-naphthalen-2-yloxypropyl)benzimidazol-2-yl]methyl]acetamide?
The InChIKey is WLZNWJQBZMHKGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3O2/c1-17(27)24-16-23-25-21-9-4-5-10-22(21)26(23)13-6-14-28-20-12-11-18-7-2-3-8-19(18)15-20/h2-5,7-12,15H,6,13-14,16H2,1H3,(H,24,27).
What are the key properties of N-[[1-(3-naphthalen-2-yloxypropyl)benzimidazol-2-yl]methyl]acetamide?
N-[[1-(3-naphthalen-2-yloxypropyl)benzimidazol-2-yl]methyl]acetamide has a molecular weight of 373.46 g/mol, XLogP of 4.29, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(3-naphthalen-2-yloxypropyl)benzimidazol-2-yl]methyl]acetamide is sourced from PubChem (CID 17005978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).