CID 23069443

C15H17O6Si — CID 23069443

IUPAC—
SMILES[Si]c1ccc(OCC2CO2)c(OCC2CO2)c1OCC1CO1
InChIInChI=1S/C15H17O6Si/c22-13-2-1-12(19-6-9-3-16-9)14(20-7-10-4-17-10)15(13)21-8-11-5-18-11/h1-2,9-11H,3-8H2
InChIKeyCVQKABQDXXBOCI-UHFFFAOYSA-N
MW321.38 g/mol
LogP-0.19
Rot. Bonds9

About CID 23069443

CID 23069443 (PubChem CID 23069443) has the molecular formula C15H17O6Si and a molecular weight of 321.38 g/mol.

Molecular Properties

Compound NameCID 23069443
PubChem CID23069443
Molecular FormulaC15H17O6Si
Molecular Weight321.38 g/mol
Exact Mass321.08
IUPAC Name—
SMILES[Si]c1ccc(OCC2CO2)c(OCC2CO2)c1OCC1CO1
InChIInChI=1S/C15H17O6Si/c22-13-2-1-12(19-6-9-3-16-9)14(20-7-10-4-17-10)15(13)21-8-11-5-18-11/h1-2,9-11H,3-8H2
InChIKeyCVQKABQDXXBOCI-UHFFFAOYSA-N
XLogP-0.19
TPSA65.28 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.38
LogP ≤ 5-0.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze CID 23069443 with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[[3-[3,5-bis[2,3,4-tris(oxiran-2-ylmethoxy)phenyl]-1-adamantyl]-2,6-bis(oxiran-2-ylmethoxy)phenoxy]methyl]oxirane
CID 87570449
2-[[2,4-bis(oxiran-2-ylmethoxy)-3-[2-(oxiran-2-ylmethoxy)phenyl]phenoxy]methyl]oxirane
CID 129094170
2-[[2-(ethoxymethoxy)-6-(oxiran-2-ylmethoxy)phenoxy]methyl]oxirane
CID 170966170
2-[[2,6-dimethyl-4-[3-methyl-4-(oxiran-2-ylmethoxy)phenyl]phenoxy]methyl]oxirane
CID 142851433
5-(oxiran-2-ylmethoxy)naphthalen-1-ol
CID 13305201
2-[[1-[2-(oxiran-2-ylmethoxy)naphthalen-1-yl]naphthalen-2-yl]oxymethyl]oxirane
CID 86159181
2-[(5-methylnaphthalen-1-yl)oxymethyl]oxirane
CID 129074160
4-(oxiran-2-ylmethoxy)naphthalene-1-carbaldehyde
CID 22999320
(2R)-2-[(2,6-dimethylphenoxy)methyl]oxirane
CID 7127515
(2S)-2-[[4-[[(2S)-oxiran-2-yl]methoxy]phenoxy]methyl]oxirane
CID 677176
2-[[2-[[2-(oxiran-2-ylmethoxy)-3-[[2-(oxiran-2-ylmethoxy)-3-[[2-(oxiran-2-ylmethoxy)phenyl]methyl]phenyl]methyl]phenyl]methyl]phenoxy]methyl]oxirane
CID 134322112
2-[[2,3,5,6-tetrabromo-4-(oxiran-2-ylmethoxy)phenoxy]methyl]oxirane
CID 57190292

Frequently Asked Questions

What is the IUPAC name of CID 23069443?
The IUPAC name of CID 23069443 (CID 23069443) is not available.
What is the SMILES notation for CID 23069443?
The canonical SMILES for CID 23069443 is [Si]c1ccc(OCC2CO2)c(OCC2CO2)c1OCC1CO1.
What is the InChIKey of CID 23069443?
The InChIKey is CVQKABQDXXBOCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17O6Si/c22-13-2-1-12(19-6-9-3-16-9)14(20-7-10-4-17-10)15(13)21-8-11-5-18-11/h1-2,9-11H,3-8H2.
What are the key properties of CID 23069443?
CID 23069443 has a molecular weight of 321.38 g/mol, XLogP of -0.19, 9 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for CID 23069443 is sourced from PubChem (CID 23069443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).