1-(1-trimethylsilylethoxymethyl)benzimidazol-5-amine

C13H21N3OSi — CID 18375891

IUPAC1-(1-trimethylsilylethoxymethyl)benzimidazol-5-amine
SMILESCC(OCn1cnc2cc(N)ccc21)[Si](C)(C)C
InChIInChI=1S/C13H21N3OSi/c1-10(18(2,3)4)17-9-16-8-15-12-7-11(14)5-6-13(12)16/h5-8,10H,9,14H2,1-4H3
InChIKeyZVVVYIJWBGEGPG-UHFFFAOYSA-N
MW263.42 g/mol
LogP2.86
Rot. Bonds4

About 1-(1-trimethylsilylethoxymethyl)benzimidazol-5-amine

1-(1-trimethylsilylethoxymethyl)benzimidazol-5-amine (PubChem CID 18375891) has the molecular formula C13H21N3OSi and a molecular weight of 263.42 g/mol. Its IUPAC name is 1-(1-trimethylsilylethoxymethyl)benzimidazol-5-amine.

Molecular Properties

Compound Name1-(1-trimethylsilylethoxymethyl)benzimidazol-5-amine
PubChem CID18375891
Molecular FormulaC13H21N3OSi
Molecular Weight263.42 g/mol
Exact Mass263.15
IUPAC Name1-(1-trimethylsilylethoxymethyl)benzimidazol-5-amine
SMILESCC(OCn1cnc2cc(N)ccc21)[Si](C)(C)C
InChIInChI=1S/C13H21N3OSi/c1-10(18(2,3)4)17-9-16-8-15-12-7-11(14)5-6-13(12)16/h5-8,10H,9,14H2,1-4H3
InChIKeyZVVVYIJWBGEGPG-UHFFFAOYSA-N
XLogP2.86
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.42
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-(benzimidazol-1-ylmethoxy)ethyl-trimethylsilane
CID 18333330
4-(5-aminobenzimidazol-1-yl)butan-2-ol
CID 64912560
1-ethylbenzimidazol-5-amine;dihydrochloride
CID 46735992
1-(2-methoxy-2-methylpropyl)benzimidazol-5-amine
CID 104765902
1-(7-methyloctyl)benzimidazol-5-amine
CID 107818163
1-(3-methylpentan-2-yl)benzimidazol-5-amine
CID 62506740
1-[(4-ethylphenyl)methyl]benzimidazol-5-amine
CID 106900793
3-(5-aminobenzimidazol-1-yl)propan-1-ol
CID 6504205
1-(2-methylpentan-3-yl)benzimidazol-5-amine
CID 62506261
1-benzylbenzimidazol-5-amine;trihydrochloride
CID 53422372
1-[(3,4-dimethoxyphenyl)methyl]benzimidazol-5-amine
CID 62506051
1-[(2-ethylphenyl)methyl]benzimidazol-5-amine
CID 64694587

Frequently Asked Questions

What is the IUPAC name of 1-(1-trimethylsilylethoxymethyl)benzimidazol-5-amine?
The IUPAC name of 1-(1-trimethylsilylethoxymethyl)benzimidazol-5-amine (CID 18375891) is 1-(1-trimethylsilylethoxymethyl)benzimidazol-5-amine.
What is the SMILES notation for 1-(1-trimethylsilylethoxymethyl)benzimidazol-5-amine?
The canonical SMILES for 1-(1-trimethylsilylethoxymethyl)benzimidazol-5-amine is CC(OCn1cnc2cc(N)ccc21)[Si](C)(C)C.
What is the InChIKey of 1-(1-trimethylsilylethoxymethyl)benzimidazol-5-amine?
The InChIKey is ZVVVYIJWBGEGPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3OSi/c1-10(18(2,3)4)17-9-16-8-15-12-7-11(14)5-6-13(12)16/h5-8,10H,9,14H2,1-4H3.
What are the key properties of 1-(1-trimethylsilylethoxymethyl)benzimidazol-5-amine?
1-(1-trimethylsilylethoxymethyl)benzimidazol-5-amine has a molecular weight of 263.42 g/mol, XLogP of 2.86, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-trimethylsilylethoxymethyl)benzimidazol-5-amine is sourced from PubChem (CID 18375891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).