1-N,1-N',2-N-trimethoxy-1-silylprop-2-ene-1,1,2-triamine

C6H17N3O3Si — CID 173071554

IUPAC1-N,1-N',2-N-trimethoxy-1-silylprop-2-ene-1,1,2-triamine
SMILESC=C(NOC)C([SiH3])(NOC)NOC
InChIInChI=1S/C6H17N3O3Si/c1-5(7-10-2)6(13,8-11-3)9-12-4/h7-9H,1H2,2-4,13H3
InChIKeyDARXCCBJCZRNTM-UHFFFAOYSA-N
MW207.31 g/mol
LogP-2.03
Rot. Bonds7

About 1-N,1-N',2-N-trimethoxy-1-silylprop-2-ene-1,1,2-triamine

1-N,1-N',2-N-trimethoxy-1-silylprop-2-ene-1,1,2-triamine (PubChem CID 173071554) has the molecular formula C6H17N3O3Si and a molecular weight of 207.31 g/mol. Its IUPAC name is 1-N,1-N',2-N-trimethoxy-1-silylprop-2-ene-1,1,2-triamine.

Molecular Properties

Compound Name1-N,1-N',2-N-trimethoxy-1-silylprop-2-ene-1,1,2-triamine
PubChem CID173071554
Molecular FormulaC6H17N3O3Si
Molecular Weight207.31 g/mol
Exact Mass207.10
IUPAC Name1-N,1-N',2-N-trimethoxy-1-silylprop-2-ene-1,1,2-triamine
SMILESC=C(NOC)C([SiH3])(NOC)NOC
InChIInChI=1S/C6H17N3O3Si/c1-5(7-10-2)6(13,8-11-3)9-12-4/h7-9H,1H2,2-4,13H3
InChIKeyDARXCCBJCZRNTM-UHFFFAOYSA-N
XLogP-2.03
TPSA63.78 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.31
LogP ≤ 5-2.03
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-N,1-N',2-N-trimethoxy-1-silylprop-2-ene-1,1,2-triamine?
The IUPAC name of 1-N,1-N',2-N-trimethoxy-1-silylprop-2-ene-1,1,2-triamine (CID 173071554) is 1-N,1-N',2-N-trimethoxy-1-silylprop-2-ene-1,1,2-triamine.
What is the SMILES notation for 1-N,1-N',2-N-trimethoxy-1-silylprop-2-ene-1,1,2-triamine?
The canonical SMILES for 1-N,1-N',2-N-trimethoxy-1-silylprop-2-ene-1,1,2-triamine is C=C(NOC)C([SiH3])(NOC)NOC.
What is the InChIKey of 1-N,1-N',2-N-trimethoxy-1-silylprop-2-ene-1,1,2-triamine?
The InChIKey is DARXCCBJCZRNTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H17N3O3Si/c1-5(7-10-2)6(13,8-11-3)9-12-4/h7-9H,1H2,2-4,13H3.
What are the key properties of 1-N,1-N',2-N-trimethoxy-1-silylprop-2-ene-1,1,2-triamine?
1-N,1-N',2-N-trimethoxy-1-silylprop-2-ene-1,1,2-triamine has a molecular weight of 207.31 g/mol, XLogP of -2.03, 7 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,1-N',2-N-trimethoxy-1-silylprop-2-ene-1,1,2-triamine is sourced from PubChem (CID 173071554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).