3-[3-(oxiran-2-ylmethoxy)propylsilyl]propan-1-amine

C9H21NO2Si — CID 175540007

IUPAC3-[3-(oxiran-2-ylmethoxy)propylsilyl]propan-1-amine
SMILESNCCC[SiH2]CCCOCC1CO1
InChIInChI=1S/C9H21NO2Si/c10-3-1-5-13-6-2-4-11-7-9-8-12-9/h9H,1-8,10,13H2
InChIKeyLIDJXFORQQCTBZ-UHFFFAOYSA-N
MW203.36 g/mol
LogP0.15
Rot. Bonds9

About 3-[3-(oxiran-2-ylmethoxy)propylsilyl]propan-1-amine

3-[3-(oxiran-2-ylmethoxy)propylsilyl]propan-1-amine (PubChem CID 175540007) has the molecular formula C9H21NO2Si and a molecular weight of 203.36 g/mol. Its IUPAC name is 3-[3-(oxiran-2-ylmethoxy)propylsilyl]propan-1-amine.

Molecular Properties

Compound Name3-[3-(oxiran-2-ylmethoxy)propylsilyl]propan-1-amine
PubChem CID175540007
Molecular FormulaC9H21NO2Si
Molecular Weight203.36 g/mol
Exact Mass203.13
IUPAC Name3-[3-(oxiran-2-ylmethoxy)propylsilyl]propan-1-amine
SMILESNCCC[SiH2]CCCOCC1CO1
InChIInChI=1S/C9H21NO2Si/c10-3-1-5-13-6-2-4-11-7-9-8-12-9/h9H,1-8,10,13H2
InChIKeyLIDJXFORQQCTBZ-UHFFFAOYSA-N
XLogP0.15
TPSA47.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.36
LogP ≤ 50.15
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': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Related Compounds

hexane-1,6-diamine;2-(oxiran-2-ylmethoxymethyl)oxirane
CID 175215443
2-[4-[4-[4-[4-[4-[4-[4-[4-[4-(oxiran-2-ylmethoxy)butoxy]butoxy]butoxy]butoxy]butoxy]butoxy]butoxy]butoxy]butoxymethyl]oxirane
CID 130476685
2-[18-(oxiran-2-ylmethoxy)octadecoxymethyl]oxirane
CID 172718038
2-[4-[4-[4-(oxiran-2-ylmethoxy)butoxy]butoxy]butoxymethyl]oxirane
CID 130476668
3-[[(4S)-1,3-dioxolan-4-yl]methoxy]propan-1-amine
CID 129395967
2,2-diethoxyethyl-[3-(oxiran-2-ylmethoxy)propyl]silane
CID 123713397
2-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(oxiran-2-ylmethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxymethyl]oxirane
CID 91036446
methoxy-[3-[2-(oxiran-2-ylmethoxy)ethoxy]propyl]silane
CID 151041352
3-(oxiran-2-ylmethoxy)propyl-propoxysilane
CID 173042510
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(oxiran-2-ylmethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxymethyl]oxirane
CID 58765936
(2R)-2-(3-methoxypropoxymethyl)oxirane
CID 130493223
2-(4-methoxybutoxymethyl)oxirane
CID 58151519

Frequently Asked Questions

What is the IUPAC name of 3-[3-(oxiran-2-ylmethoxy)propylsilyl]propan-1-amine?
The IUPAC name of 3-[3-(oxiran-2-ylmethoxy)propylsilyl]propan-1-amine (CID 175540007) is 3-[3-(oxiran-2-ylmethoxy)propylsilyl]propan-1-amine.
What is the SMILES notation for 3-[3-(oxiran-2-ylmethoxy)propylsilyl]propan-1-amine?
The canonical SMILES for 3-[3-(oxiran-2-ylmethoxy)propylsilyl]propan-1-amine is NCCC[SiH2]CCCOCC1CO1.
What is the InChIKey of 3-[3-(oxiran-2-ylmethoxy)propylsilyl]propan-1-amine?
The InChIKey is LIDJXFORQQCTBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21NO2Si/c10-3-1-5-13-6-2-4-11-7-9-8-12-9/h9H,1-8,10,13H2.
What are the key properties of 3-[3-(oxiran-2-ylmethoxy)propylsilyl]propan-1-amine?
3-[3-(oxiran-2-ylmethoxy)propylsilyl]propan-1-amine has a molecular weight of 203.36 g/mol, XLogP of 0.15, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(oxiran-2-ylmethoxy)propylsilyl]propan-1-amine is sourced from PubChem (CID 175540007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).