5-diethoxysilylheptan-1-amine

C11H27NO2Si — CID 154490581

IUPAC5-diethoxysilylheptan-1-amine
SMILESCCO[SiH](OCC)C(CC)CCCCN
InChIInChI=1S/C11H27NO2Si/c1-4-11(9-7-8-10-12)15(13-5-2)14-6-3/h11,15H,4-10,12H2,1-3H3
InChIKeyLZGFAJKOQPGHDE-UHFFFAOYSA-N
MW233.43 g/mol
LogP2.19
Rot. Bonds10

About 5-diethoxysilylheptan-1-amine

5-diethoxysilylheptan-1-amine (PubChem CID 154490581) has the molecular formula C11H27NO2Si and a molecular weight of 233.43 g/mol. Its IUPAC name is 5-diethoxysilylheptan-1-amine.

Molecular Properties

Compound Name5-diethoxysilylheptan-1-amine
PubChem CID154490581
Molecular FormulaC11H27NO2Si
Molecular Weight233.43 g/mol
Exact Mass233.18
IUPAC Name5-diethoxysilylheptan-1-amine
SMILESCCO[SiH](OCC)C(CC)CCCCN
InChIInChI=1S/C11H27NO2Si/c1-4-11(9-7-8-10-12)15(13-5-2)14-6-3/h11,15H,4-10,12H2,1-3H3
InChIKeyLZGFAJKOQPGHDE-UHFFFAOYSA-N
XLogP2.19
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.43
LogP ≤ 52.19
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'}

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Related Compounds

4-diethoxysilyloctan-1-amine
CID 173012099
ethyl N-(5-diethoxysilylheptyl)carbamate
CID 154096304
methyl N-(4-diethoxysilylhexyl)carbamate
CID 154100096
4-diethoxysilylhexyl(methyl)carbamic acid
CID 173191134
1-N,4-N-bis(3-diethoxysilylpentyl)benzene-1,4-diamine
CID 154210482
4-diethoxysilylheptane-1-thiol
CID 173009934
methyl N-(3-diethoxysilylpentyl)carbamate
CID 154173330
8-amino-1-ethoxyoctan-1-ol
CID 89136202
12-ethyltetradecan-1-amine
CID 87456130
3-[3-aminopropyl(ethoxy)silyl]propan-1-amine
CID 175017432
ethane;5-methylheptan-1-amine
CID 143088899
decane-1,9-diamine
CID 23448369

Frequently Asked Questions

What is the IUPAC name of 5-diethoxysilylheptan-1-amine?
The IUPAC name of 5-diethoxysilylheptan-1-amine (CID 154490581) is 5-diethoxysilylheptan-1-amine.
What is the SMILES notation for 5-diethoxysilylheptan-1-amine?
The canonical SMILES for 5-diethoxysilylheptan-1-amine is CCO[SiH](OCC)C(CC)CCCCN.
What is the InChIKey of 5-diethoxysilylheptan-1-amine?
The InChIKey is LZGFAJKOQPGHDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H27NO2Si/c1-4-11(9-7-8-10-12)15(13-5-2)14-6-3/h11,15H,4-10,12H2,1-3H3.
What are the key properties of 5-diethoxysilylheptan-1-amine?
5-diethoxysilylheptan-1-amine has a molecular weight of 233.43 g/mol, XLogP of 2.19, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-diethoxysilylheptan-1-amine is sourced from PubChem (CID 154490581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).