2-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-1H-benzimidazole

C14H20N2O3 — CID 66737942

IUPAC2-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-1H-benzimidazole
SMILESCOCCOCCOCCc1nc2ccccc2[nH]1
InChIInChI=1S/C14H20N2O3/c1-17-8-9-19-11-10-18-7-6-14-15-12-4-2-3-5-13(12)16-14/h2-5H,6-11H2,1H3,(H,15,16)
InChIKeyYFHIOCUTDYXXSH-UHFFFAOYSA-N
MW264.32 g/mol
LogP1.78
Rot. Bonds9

About 2-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-1H-benzimidazole

2-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-1H-benzimidazole (PubChem CID 66737942) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is 2-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-1H-benzimidazole.

Molecular Properties

Compound Name2-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-1H-benzimidazole
PubChem CID66737942
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC Name2-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-1H-benzimidazole
SMILESCOCCOCCOCCc1nc2ccccc2[nH]1
InChIInChI=1S/C14H20N2O3/c1-17-8-9-19-11-10-18-7-6-14-15-12-4-2-3-5-13(12)16-14/h2-5H,6-11H2,1H3,(H,15,16)
InChIKeyYFHIOCUTDYXXSH-UHFFFAOYSA-N
XLogP1.78
TPSA56.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[2-(2,2,2-trifluoroethoxy)ethyl]-1H-benzimidazole
CID 103208831
O-[2-(1H-benzimidazol-2-yl)ethyl]hydroxylamine
CID 142734516
2-(2-methoxyethylsulfanylmethyl)-1H-benzimidazole
CID 18811154
CID 87640795
CID 87640795
2-[7-(1H-benzimidazol-2-yl)heptyl]-1H-benzimidazole dichloride
CID 21205310
N-(1H-benzimidazol-2-ylmethyl)-3-methoxypropan-1-amine
CID 83961851
N-[2-(1H-benzimidazol-2-yl)ethyl]-2-(2-methoxyethylsulfanyl)acetamide
CID 39489394
2-[2-(3-methylphenoxy)ethyl]-1H-benzimidazole
CID 43236517
methyl 6-(1H-benzimidazol-2-yl)hexanoate
CID 11265100
2-docosyl-1H-benzimidazole
CID 141189761
[(2R)-4-(1H-benzimidazol-2-yl)-1-methoxy-1-oxobutan-2-yl]azanium
CID 6923317
2-(pentoxymethyl)-1H-benzimidazole
CID 139950764

Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-1H-benzimidazole?
The IUPAC name of 2-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-1H-benzimidazole (CID 66737942) is 2-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-1H-benzimidazole.
What is the SMILES notation for 2-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-1H-benzimidazole?
The canonical SMILES for 2-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-1H-benzimidazole is COCCOCCOCCc1nc2ccccc2[nH]1.
What is the InChIKey of 2-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-1H-benzimidazole?
The InChIKey is YFHIOCUTDYXXSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-17-8-9-19-11-10-18-7-6-14-15-12-4-2-3-5-13(12)16-14/h2-5H,6-11H2,1H3,(H,15,16).
What are the key properties of 2-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-1H-benzimidazole?
2-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-1H-benzimidazole has a molecular weight of 264.32 g/mol, XLogP of 1.78, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-1H-benzimidazole is sourced from PubChem (CID 66737942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).