N-[2-[1-(2-methoxyethyl)benzimidazol-2-yl]ethyl]butanamide

C16H23N3O2 — CID 16974505

IUPACN-[2-[1-(2-methoxyethyl)benzimidazol-2-yl]ethyl]butanamide
SMILESCCCC(=O)NCCc1nc2ccccc2n1CCOC
InChIInChI=1S/C16H23N3O2/c1-3-6-16(20)17-10-9-15-18-13-7-4-5-8-14(13)19(15)11-12-21-2/h4-5,7-8H,3,6,9-12H2,1-2H3,(H,17,20)
InChIKeyZZUROYQHIJVBOS-UHFFFAOYSA-N
MW289.38 g/mol
LogP2.14
Rot. Bonds8

About N-[2-[1-(2-methoxyethyl)benzimidazol-2-yl]ethyl]butanamide

N-[2-[1-(2-methoxyethyl)benzimidazol-2-yl]ethyl]butanamide (PubChem CID 16974505) has the molecular formula C16H23N3O2 and a molecular weight of 289.38 g/mol. Its IUPAC name is N-[2-[1-(2-methoxyethyl)benzimidazol-2-yl]ethyl]butanamide.

Molecular Properties

Compound NameN-[2-[1-(2-methoxyethyl)benzimidazol-2-yl]ethyl]butanamide
PubChem CID16974505
Molecular FormulaC16H23N3O2
Molecular Weight289.38 g/mol
Exact Mass289.18
IUPAC NameN-[2-[1-(2-methoxyethyl)benzimidazol-2-yl]ethyl]butanamide
SMILESCCCC(=O)NCCc1nc2ccccc2n1CCOC
InChIInChI=1S/C16H23N3O2/c1-3-6-16(20)17-10-9-15-18-13-7-4-5-8-14(13)19(15)11-12-21-2/h4-5,7-8H,3,6,9-12H2,1-2H3,(H,17,20)
InChIKeyZZUROYQHIJVBOS-UHFFFAOYSA-N
XLogP2.14
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[2-[1-(2-methoxyethyl)benzimidazol-2-yl]ethyl]butanamide 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-(2-methoxyethyl)benzimidazol-2-yl]methyl]butanamide
CID 16968967
N-[2-[1-(2-phenoxyethyl)benzimidazol-2-yl]ethyl]butanamide
CID 16974426
N-[2-[1-[2-(4-tert-butylphenoxy)ethyl]benzimidazol-2-yl]ethyl]butanamide
CID 16974448
2-methoxy-N-[3-[1-(2-methoxyethyl)benzimidazol-2-yl]propyl]acetamide
CID 16981376
N-[2-[1-[2-(2,5-dimethylphenoxy)ethyl]benzimidazol-2-yl]ethyl]butanamide
CID 16974430
2-methoxy-N-[2-(1-nonylbenzimidazol-2-yl)ethyl]acetamide
CID 16974546
N-[2-[1-[3-(2-chlorophenoxy)propyl]benzimidazol-2-yl]ethyl]butanamide
CID 16974464
N-[2-[1-(2-ethoxyethyl)benzimidazol-2-yl]ethyl]propanamide
CID 16974362
N-[2-[1-(2-methoxyethyl)benzimidazol-2-yl]ethyl]pyridine-2-carboxamide
CID 16966463
N-[2-[1-[2-(2-ethoxyphenoxy)ethyl]benzimidazol-2-yl]ethyl]-2-methoxyacetamide
CID 16974588
N-[2-[1-(naphthalen-1-ylmethyl)benzimidazol-2-yl]ethyl]butanamide
CID 16974420
N-[2-[1-(2-anilino-2-oxoethyl)benzimidazol-2-yl]ethyl]butanamide
CID 17030370

Frequently Asked Questions

What is the IUPAC name of N-[2-[1-(2-methoxyethyl)benzimidazol-2-yl]ethyl]butanamide?
The IUPAC name of N-[2-[1-(2-methoxyethyl)benzimidazol-2-yl]ethyl]butanamide (CID 16974505) is N-[2-[1-(2-methoxyethyl)benzimidazol-2-yl]ethyl]butanamide.
What is the SMILES notation for N-[2-[1-(2-methoxyethyl)benzimidazol-2-yl]ethyl]butanamide?
The canonical SMILES for N-[2-[1-(2-methoxyethyl)benzimidazol-2-yl]ethyl]butanamide is CCCC(=O)NCCc1nc2ccccc2n1CCOC.
What is the InChIKey of N-[2-[1-(2-methoxyethyl)benzimidazol-2-yl]ethyl]butanamide?
The InChIKey is ZZUROYQHIJVBOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O2/c1-3-6-16(20)17-10-9-15-18-13-7-4-5-8-14(13)19(15)11-12-21-2/h4-5,7-8H,3,6,9-12H2,1-2H3,(H,17,20).
What are the key properties of N-[2-[1-(2-methoxyethyl)benzimidazol-2-yl]ethyl]butanamide?
N-[2-[1-(2-methoxyethyl)benzimidazol-2-yl]ethyl]butanamide has a molecular weight of 289.38 g/mol, XLogP of 2.14, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[1-(2-methoxyethyl)benzimidazol-2-yl]ethyl]butanamide is sourced from PubChem (CID 16974505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).