trimethoxy-[3-(1-propan-2-ylimidazol-2-yl)propyl]silane

C12H24N2O3Si — CID 69231533

IUPACtrimethoxy-[3-(1-propan-2-ylimidazol-2-yl)propyl]silane
SMILESCO[Si](CCCc1nccn1C(C)C)(OC)OC
InChIInChI=1S/C12H24N2O3Si/c1-11(2)14-9-8-13-12(14)7-6-10-18(15-3,16-4)17-5/h8-9,11H,6-7,10H2,1-5H3
InChIKeyQRCGUMYMEITQOT-UHFFFAOYSA-N
MW272.42 g/mol
LogP2.27
Rot. Bonds8

About trimethoxy-[3-(1-propan-2-ylimidazol-2-yl)propyl]silane

trimethoxy-[3-(1-propan-2-ylimidazol-2-yl)propyl]silane (PubChem CID 69231533) has the molecular formula C12H24N2O3Si and a molecular weight of 272.42 g/mol. Its IUPAC name is trimethoxy-[3-(1-propan-2-ylimidazol-2-yl)propyl]silane.

Molecular Properties

Compound Nametrimethoxy-[3-(1-propan-2-ylimidazol-2-yl)propyl]silane
PubChem CID69231533
Molecular FormulaC12H24N2O3Si
Molecular Weight272.42 g/mol
Exact Mass272.16
IUPAC Nametrimethoxy-[3-(1-propan-2-ylimidazol-2-yl)propyl]silane
SMILESCO[Si](CCCc1nccn1C(C)C)(OC)OC
InChIInChI=1S/C12H24N2O3Si/c1-11(2)14-9-8-13-12(14)7-6-10-18(15-3,16-4)17-5/h8-9,11H,6-7,10H2,1-5H3
InChIKeyQRCGUMYMEITQOT-UHFFFAOYSA-N
XLogP2.27
TPSA45.51 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.42
LogP ≤ 52.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

triethoxy-[3-(1-heptadecan-2-ylimidazol-2-yl)propyl]silane
CID 69233652
2-(2-methoxyethoxy)-N-[(1-propan-2-ylimidazol-2-yl)methyl]acetamide
CID 91790838
1-(2-undecylimidazol-1-yl)ethanamine
CID 21242197
2-[(4-chlorophenoxy)methyl]-1-propan-2-ylimidazole
CID 117187741
4-chloro-2,5-dimethoxy-N-[(1-propan-2-ylimidazol-2-yl)methyl]aniline
CID 84586952
(2S)-3-methyl-2-[(1-propan-2-ylimidazol-2-yl)methylamino]butan-1-ol
CID 75501743
2-[(4-bromophenyl)methyl]-1-propan-2-ylimidazole
CID 82561826
1-(difluoromethyl)-2-(3-methylbutyl)imidazole
CID 170928418
[1-[(1-propan-2-ylimidazol-2-yl)methyl]azetidin-2-yl]methanamine
CID 165488496
N-ethyl-1-(1-propan-2-ylimidazol-2-yl)methanesulfonamide
CID 71635472
N-[(1-propan-2-ylimidazol-2-yl)methyl]cyclopentanamine
CID 117187481
methyl (2R,4R)-4-hydroxy-1-[(1-propan-2-ylimidazol-2-yl)methyl]pyrrolidine-2-carboxylate
CID 99822568

Frequently Asked Questions

What is the IUPAC name of trimethoxy-[3-(1-propan-2-ylimidazol-2-yl)propyl]silane?
The IUPAC name of trimethoxy-[3-(1-propan-2-ylimidazol-2-yl)propyl]silane (CID 69231533) is trimethoxy-[3-(1-propan-2-ylimidazol-2-yl)propyl]silane.
What is the SMILES notation for trimethoxy-[3-(1-propan-2-ylimidazol-2-yl)propyl]silane?
The canonical SMILES for trimethoxy-[3-(1-propan-2-ylimidazol-2-yl)propyl]silane is CO[Si](CCCc1nccn1C(C)C)(OC)OC.
What is the InChIKey of trimethoxy-[3-(1-propan-2-ylimidazol-2-yl)propyl]silane?
The InChIKey is QRCGUMYMEITQOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O3Si/c1-11(2)14-9-8-13-12(14)7-6-10-18(15-3,16-4)17-5/h8-9,11H,6-7,10H2,1-5H3.
What are the key properties of trimethoxy-[3-(1-propan-2-ylimidazol-2-yl)propyl]silane?
trimethoxy-[3-(1-propan-2-ylimidazol-2-yl)propyl]silane has a molecular weight of 272.42 g/mol, XLogP of 2.27, 8 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for trimethoxy-[3-(1-propan-2-ylimidazol-2-yl)propyl]silane is sourced from PubChem (CID 69231533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).