1-pyrrolidin-3-ylethanamine;triethoxysilane

C12H30N2O3Si — CID 173046931

IUPAC1-pyrrolidin-3-ylethanamine;triethoxysilane
SMILESCC(N)C1CCNC1.CCO[SiH](OCC)OCC
InChIInChI=1S/C6H14N2.C6H16O3Si/c1-5(7)6-2-3-8-4-6;1-4-7-10(8-5-2)9-6-3/h5-6,8H,2-4,7H2,1H3;10H,4-6H2,1-3H3
InChIKeyGGOJDPGOVLTFTM-UHFFFAOYSA-N
MW278.47 g/mol
LogP0.76
Rot. Bonds7

About 1-pyrrolidin-3-ylethanamine;triethoxysilane

1-pyrrolidin-3-ylethanamine;triethoxysilane (PubChem CID 173046931) has the molecular formula C12H30N2O3Si and a molecular weight of 278.47 g/mol. Its IUPAC name is 1-pyrrolidin-3-ylethanamine;triethoxysilane.

Molecular Properties

Compound Name1-pyrrolidin-3-ylethanamine;triethoxysilane
PubChem CID173046931
Molecular FormulaC12H30N2O3Si
Molecular Weight278.47 g/mol
Exact Mass278.20
IUPAC Name1-pyrrolidin-3-ylethanamine;triethoxysilane
SMILESCC(N)C1CCNC1.CCO[SiH](OCC)OCC
InChIInChI=1S/C6H14N2.C6H16O3Si/c1-5(7)6-2-3-8-4-6;1-4-7-10(8-5-2)9-6-3/h5-6,8H,2-4,7H2,1H3;10H,4-6H2,1-3H3
InChIKeyGGOJDPGOVLTFTM-UHFFFAOYSA-N
XLogP0.76
TPSA65.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.47
LogP ≤ 50.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

1-(azacyclododec-3-yl)ethanamine;tripropoxysilane
CID 173123595
ethyl (2S)-2-fluoro-2-[(3S)-pyrrolidin-3-yl]acetate
CID 125086128
3-methyl-1-pyrrolidin-3-ylbutan-1-amine
CID 82416019
(1S)-1-(azetidin-3-yl)ethanamine
CID 96955547
1-(azetidin-3-yl)ethanamine;diethoxymethylsilane
CID 173107228
(1S)-N-ethyl-1-[(3S)-pyrrolidin-3-yl]ethanamine
CID 10034728
2-pyrrolidin-3-ylbutan-1-amine
CID 82594434
(3R)-3-(1-iodoethyl)pyrrolidine
CID 89293649
azepane;triethoxysilane
CID 173012109
ethane;N-ethyl-1-pyrrolidin-3-ylethanamine;propane
CID 143400696
1-(2-methylaziridin-1-yl)ethanamine;triethoxysilane
CID 173187116
(3S)-3-[(1R)-1-azidoethyl]pyrrolidine
CID 150048976

Frequently Asked Questions

What is the IUPAC name of 1-pyrrolidin-3-ylethanamine;triethoxysilane?
The IUPAC name of 1-pyrrolidin-3-ylethanamine;triethoxysilane (CID 173046931) is 1-pyrrolidin-3-ylethanamine;triethoxysilane.
What is the SMILES notation for 1-pyrrolidin-3-ylethanamine;triethoxysilane?
The canonical SMILES for 1-pyrrolidin-3-ylethanamine;triethoxysilane is CC(N)C1CCNC1.CCO[SiH](OCC)OCC.
What is the InChIKey of 1-pyrrolidin-3-ylethanamine;triethoxysilane?
The InChIKey is GGOJDPGOVLTFTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2.C6H16O3Si/c1-5(7)6-2-3-8-4-6;1-4-7-10(8-5-2)9-6-3/h5-6,8H,2-4,7H2,1H3;10H,4-6H2,1-3H3.
What are the key properties of 1-pyrrolidin-3-ylethanamine;triethoxysilane?
1-pyrrolidin-3-ylethanamine;triethoxysilane has a molecular weight of 278.47 g/mol, XLogP of 0.76, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pyrrolidin-3-ylethanamine;triethoxysilane is sourced from PubChem (CID 173046931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).