2-methyl-2-trimethoxysilylpentan-3-amine

C9H23NO3Si — CID 87850746

IUPAC2-methyl-2-trimethoxysilylpentan-3-amine
SMILESCCC(N)C(C)(C)[Si](OC)(OC)OC
InChIInChI=1S/C9H23NO3Si/c1-7-8(10)9(2,3)14(11-4,12-5)13-6/h8H,7,10H2,1-6H3
InChIKeyBRBNGWQKHGDHDV-UHFFFAOYSA-N
MW221.37 g/mol
LogP1.38
Rot. Bonds6

About 2-methyl-2-trimethoxysilylpentan-3-amine

2-methyl-2-trimethoxysilylpentan-3-amine (PubChem CID 87850746) has the molecular formula C9H23NO3Si and a molecular weight of 221.37 g/mol. Its IUPAC name is 2-methyl-2-trimethoxysilylpentan-3-amine.

Molecular Properties

Compound Name2-methyl-2-trimethoxysilylpentan-3-amine
PubChem CID87850746
Molecular FormulaC9H23NO3Si
Molecular Weight221.37 g/mol
Exact Mass221.14
IUPAC Name2-methyl-2-trimethoxysilylpentan-3-amine
SMILESCCC(N)C(C)(C)[Si](OC)(OC)OC
InChIInChI=1S/C9H23NO3Si/c1-7-8(10)9(2,3)14(11-4,12-5)13-6/h8H,7,10H2,1-6H3
InChIKeyBRBNGWQKHGDHDV-UHFFFAOYSA-N
XLogP1.38
TPSA53.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.37
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-trimethoxysilylpentan-3-amine?
The IUPAC name of 2-methyl-2-trimethoxysilylpentan-3-amine (CID 87850746) is 2-methyl-2-trimethoxysilylpentan-3-amine.
What is the SMILES notation for 2-methyl-2-trimethoxysilylpentan-3-amine?
The canonical SMILES for 2-methyl-2-trimethoxysilylpentan-3-amine is CCC(N)C(C)(C)[Si](OC)(OC)OC.
What is the InChIKey of 2-methyl-2-trimethoxysilylpentan-3-amine?
The InChIKey is BRBNGWQKHGDHDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H23NO3Si/c1-7-8(10)9(2,3)14(11-4,12-5)13-6/h8H,7,10H2,1-6H3.
What are the key properties of 2-methyl-2-trimethoxysilylpentan-3-amine?
2-methyl-2-trimethoxysilylpentan-3-amine has a molecular weight of 221.37 g/mol, XLogP of 1.38, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-trimethoxysilylpentan-3-amine is sourced from PubChem (CID 87850746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).