5-(1,1,2-trimethoxysilinan-2-yl)pentan-1-amine

C13H29NO3Si — CID 174387046

IUPAC5-(1,1,2-trimethoxysilinan-2-yl)pentan-1-amine
SMILESCOC1(CCCCCN)CCCC[Si]1(OC)OC
InChIInChI=1S/C13H29NO3Si/c1-15-13(9-5-4-7-11-14)10-6-8-12-18(13,16-2)17-3/h4-12,14H2,1-3H3
InChIKeySXQDRHOGIKURMQ-UHFFFAOYSA-N
MW275.46 g/mol
LogP2.35
Rot. Bonds8

About 5-(1,1,2-trimethoxysilinan-2-yl)pentan-1-amine

5-(1,1,2-trimethoxysilinan-2-yl)pentan-1-amine (PubChem CID 174387046) has the molecular formula C13H29NO3Si and a molecular weight of 275.46 g/mol. Its IUPAC name is 5-(1,1,2-trimethoxysilinan-2-yl)pentan-1-amine.

Molecular Properties

Compound Name5-(1,1,2-trimethoxysilinan-2-yl)pentan-1-amine
PubChem CID174387046
Molecular FormulaC13H29NO3Si
Molecular Weight275.46 g/mol
Exact Mass275.19
IUPAC Name5-(1,1,2-trimethoxysilinan-2-yl)pentan-1-amine
SMILESCOC1(CCCCCN)CCCC[Si]1(OC)OC
InChIInChI=1S/C13H29NO3Si/c1-15-13(9-5-4-7-11-14)10-6-8-12-18(13,16-2)17-3/h4-12,14H2,1-3H3
InChIKeySXQDRHOGIKURMQ-UHFFFAOYSA-N
XLogP2.35
TPSA53.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.46
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 5-(1,1,2-trimethoxysilinan-2-yl)pentan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-(1,1,2-trimethoxysilinan-2-yl)pentan-1-amine?
The IUPAC name of 5-(1,1,2-trimethoxysilinan-2-yl)pentan-1-amine (CID 174387046) is 5-(1,1,2-trimethoxysilinan-2-yl)pentan-1-amine.
What is the SMILES notation for 5-(1,1,2-trimethoxysilinan-2-yl)pentan-1-amine?
The canonical SMILES for 5-(1,1,2-trimethoxysilinan-2-yl)pentan-1-amine is COC1(CCCCCN)CCCC[Si]1(OC)OC.
What is the InChIKey of 5-(1,1,2-trimethoxysilinan-2-yl)pentan-1-amine?
The InChIKey is SXQDRHOGIKURMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H29NO3Si/c1-15-13(9-5-4-7-11-14)10-6-8-12-18(13,16-2)17-3/h4-12,14H2,1-3H3.
What are the key properties of 5-(1,1,2-trimethoxysilinan-2-yl)pentan-1-amine?
5-(1,1,2-trimethoxysilinan-2-yl)pentan-1-amine has a molecular weight of 275.46 g/mol, XLogP of 2.35, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1,1,2-trimethoxysilinan-2-yl)pentan-1-amine is sourced from PubChem (CID 174387046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).