4-(1,1-diethoxyethylsilyl)butan-1-amine

C10H25NO2Si — CID 71340300

IUPAC4-(1,1-diethoxyethylsilyl)butan-1-amine
SMILESCCOC(C)(OCC)[SiH2]CCCCN
InChIInChI=1S/C10H25NO2Si/c1-4-12-10(3,13-5-2)14-9-7-6-8-11/h4-9,11,14H2,1-3H3
InChIKeyIWDWLHGDXBGNPR-UHFFFAOYSA-N
MW219.40 g/mol
LogP1.06
Rot. Bonds9

About 4-(1,1-diethoxyethylsilyl)butan-1-amine

4-(1,1-diethoxyethylsilyl)butan-1-amine (PubChem CID 71340300) has the molecular formula C10H25NO2Si and a molecular weight of 219.40 g/mol. Its IUPAC name is 4-(1,1-diethoxyethylsilyl)butan-1-amine.

Molecular Properties

Compound Name4-(1,1-diethoxyethylsilyl)butan-1-amine
PubChem CID71340300
Molecular FormulaC10H25NO2Si
Molecular Weight219.40 g/mol
Exact Mass219.17
IUPAC Name4-(1,1-diethoxyethylsilyl)butan-1-amine
SMILESCCOC(C)(OCC)[SiH2]CCCCN
InChIInChI=1S/C10H25NO2Si/c1-4-12-10(3,13-5-2)14-9-7-6-8-11/h4-9,11,14H2,1-3H3
InChIKeyIWDWLHGDXBGNPR-UHFFFAOYSA-N
XLogP1.06
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.40
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

3-bromopropyl(1,1-diethoxyethyl)silane
CID 173419111
1,1-dimethoxyethyl-[4-(1,1-dimethoxyethylsilyl)butyl]silane
CID 173017003
1,1-dipropoxyethyl-[2-(1,1-dipropoxyethylsilyl)ethyl]silane
CID 173016785
7-amino-2-ethoxy-2-methylheptan-3-one
CID 146555054
4-[(2-methylpropan-2-yl)oxy]butan-1-amine
CID 18672802
1,1-diethoxyethyl(ethoxy)silane
CID 164998800
5-methylsilylpentan-1-amine
CID 175183110
7-(triethoxymethyl)pentadecan-1-amine
CID 150888831
3-ethylsilylpropan-1-amine
CID 159309450
3-(1,1-diethoxypropylsilyl)propylurea
CID 175352143
propane-1,3-diamine;propane-2,2-diamine
CID 159356345
2-(1,2-13C2)ethoxy-2-(113C)methyl(1,2,3-13C3)propane
CID 71309473

Frequently Asked Questions

What is the IUPAC name of 4-(1,1-diethoxyethylsilyl)butan-1-amine?
The IUPAC name of 4-(1,1-diethoxyethylsilyl)butan-1-amine (CID 71340300) is 4-(1,1-diethoxyethylsilyl)butan-1-amine.
What is the SMILES notation for 4-(1,1-diethoxyethylsilyl)butan-1-amine?
The canonical SMILES for 4-(1,1-diethoxyethylsilyl)butan-1-amine is CCOC(C)(OCC)[SiH2]CCCCN.
What is the InChIKey of 4-(1,1-diethoxyethylsilyl)butan-1-amine?
The InChIKey is IWDWLHGDXBGNPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H25NO2Si/c1-4-12-10(3,13-5-2)14-9-7-6-8-11/h4-9,11,14H2,1-3H3.
What are the key properties of 4-(1,1-diethoxyethylsilyl)butan-1-amine?
4-(1,1-diethoxyethylsilyl)butan-1-amine has a molecular weight of 219.40 g/mol, XLogP of 1.06, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1,1-diethoxyethylsilyl)butan-1-amine is sourced from PubChem (CID 71340300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).