3-methyl-2-propyl-1,5,6,7-tetrahydropyrrolo[1,2-c][1,3,2]diazasilin-8-ium

C10H19N2Si+ — CID 123142844

IUPAC3-methyl-2-propyl-1,5,6,7-tetrahydropyrrolo[1,2-c][1,3,2]diazasilin-8-ium
SMILESCCCN1[SiH2][N+]2=C(C=C1C)CCC2
InChIInChI=1S/C10H19N2Si/c1-3-6-11-9(2)8-10-5-4-7-12(10)13-11/h8H,3-7,13H2,1-2H3/q+1
InChIKeyZNUBLGRLRPOVBG-UHFFFAOYSA-N
MW195.36 g/mol
LogP0.86
Rot. Bonds2

About 3-methyl-2-propyl-1,5,6,7-tetrahydropyrrolo[1,2-c][1,3,2]diazasilin-8-ium

3-methyl-2-propyl-1,5,6,7-tetrahydropyrrolo[1,2-c][1,3,2]diazasilin-8-ium (PubChem CID 123142844) has the molecular formula C10H19N2Si+ and a molecular weight of 195.36 g/mol. Its IUPAC name is 3-methyl-2-propyl-1,5,6,7-tetrahydropyrrolo[1,2-c][1,3,2]diazasilin-8-ium.

Molecular Properties

Compound Name3-methyl-2-propyl-1,5,6,7-tetrahydropyrrolo[1,2-c][1,3,2]diazasilin-8-ium
PubChem CID123142844
Molecular FormulaC10H19N2Si+
Molecular Weight195.36 g/mol
Exact Mass195.13
IUPAC Name3-methyl-2-propyl-1,5,6,7-tetrahydropyrrolo[1,2-c][1,3,2]diazasilin-8-ium
SMILESCCCN1[SiH2][N+]2=C(C=C1C)CCC2
InChIInChI=1S/C10H19N2Si/c1-3-6-11-9(2)8-10-5-4-7-12(10)13-11/h8H,3-7,13H2,1-2H3/q+1
InChIKeyZNUBLGRLRPOVBG-UHFFFAOYSA-N
XLogP0.86
TPSA6.25 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.36
LogP ≤ 50.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 3-methyl-2-propyl-1,5,6,7-tetrahydropyrrolo[1,2-c][1,3,2]diazasilin-8-ium?
The IUPAC name of 3-methyl-2-propyl-1,5,6,7-tetrahydropyrrolo[1,2-c][1,3,2]diazasilin-8-ium (CID 123142844) is 3-methyl-2-propyl-1,5,6,7-tetrahydropyrrolo[1,2-c][1,3,2]diazasilin-8-ium.
What is the SMILES notation for 3-methyl-2-propyl-1,5,6,7-tetrahydropyrrolo[1,2-c][1,3,2]diazasilin-8-ium?
The canonical SMILES for 3-methyl-2-propyl-1,5,6,7-tetrahydropyrrolo[1,2-c][1,3,2]diazasilin-8-ium is CCCN1[SiH2][N+]2=C(C=C1C)CCC2.
What is the InChIKey of 3-methyl-2-propyl-1,5,6,7-tetrahydropyrrolo[1,2-c][1,3,2]diazasilin-8-ium?
The InChIKey is ZNUBLGRLRPOVBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N2Si/c1-3-6-11-9(2)8-10-5-4-7-12(10)13-11/h8H,3-7,13H2,1-2H3/q+1.
What are the key properties of 3-methyl-2-propyl-1,5,6,7-tetrahydropyrrolo[1,2-c][1,3,2]diazasilin-8-ium?
3-methyl-2-propyl-1,5,6,7-tetrahydropyrrolo[1,2-c][1,3,2]diazasilin-8-ium has a molecular weight of 195.36 g/mol, XLogP of 0.86, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2-propyl-1,5,6,7-tetrahydropyrrolo[1,2-c][1,3,2]diazasilin-8-ium is sourced from PubChem (CID 123142844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).