CID 58422055

C11H19NO3Si — CID 58422055

IUPAC—
SMILESC=C(C)C(=O)CCOC(=O)NCCC[Si]C
InChIInChI=1S/C11H19NO3Si/c1-9(2)10(13)5-7-15-11(14)12-6-4-8-16-3/h1,4-8H2,2-3H3,(H,12,14)
InChIKeyFTPOBUQNCLRWLE-UHFFFAOYSA-N
MW241.36 g/mol
LogP1.81
Rot. Bonds8

About CID 58422055

CID 58422055 (PubChem CID 58422055) has the molecular formula C11H19NO3Si and a molecular weight of 241.36 g/mol.

Molecular Properties

Compound NameCID 58422055
PubChem CID58422055
Molecular FormulaC11H19NO3Si
Molecular Weight241.36 g/mol
Exact Mass241.11
IUPAC Name—
SMILESC=C(C)C(=O)CCOC(=O)NCCC[Si]C
InChIInChI=1S/C11H19NO3Si/c1-9(2)10(13)5-7-15-11(14)12-6-4-8-16-3/h1,4-8H2,2-3H3,(H,12,14)
InChIKeyFTPOBUQNCLRWLE-UHFFFAOYSA-N
XLogP1.81
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.36
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze CID 58422055 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

(4-methyl-3-oxopent-4-enyl) carbamate
CID 137378458
(4-methyl-3-oxopent-4-enyl) 2-methylprop-2-enoate
CID 18739125
CID 19011194
CID 19011194
6-[2-(2-methylprop-2-enoyloxy)ethoxycarbonylamino]hexanoic acid
CID 143847677
3-[2-(2-methylprop-2-enoyloxy)ethylcarbamoyloxy]propanoic acid
CID 88965929
3-[2-(2-methylprop-2-enoyloxy)ethoxycarbonylamino]propylcarbamic acid
CID 149304410
6-(3-trimethoxysilylpropylcarbamoyloxy)hexyl 2-methylprop-2-enoate
CID 171791213
2-(heptadecylcarbamoyloxy)ethyl 2-methylprop-2-enoate
CID 171651386
2-(6-aminohexylcarbamoyloxy)ethyl 2-methylprop-2-enoate
CID 88900855
ethyl N-(4-methylpent-4-enyl)carbamate
CID 123482675
(4-methyl-3-oxopent-4-enyl) butanoate
CID 170015933
3-[dimethoxy(methyl)silyl]propyl N-[2-(3-methyl-2-oxobut-3-enoxy)ethyl]carbamate
CID 158336407

Frequently Asked Questions

What is the IUPAC name of CID 58422055?
The IUPAC name of CID 58422055 (CID 58422055) is not available.
What is the SMILES notation for CID 58422055?
The canonical SMILES for CID 58422055 is C=C(C)C(=O)CCOC(=O)NCCC[Si]C.
What is the InChIKey of CID 58422055?
The InChIKey is FTPOBUQNCLRWLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO3Si/c1-9(2)10(13)5-7-15-11(14)12-6-4-8-16-3/h1,4-8H2,2-3H3,(H,12,14).
What are the key properties of CID 58422055?
CID 58422055 has a molecular weight of 241.36 g/mol, XLogP of 1.81, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 58422055 is sourced from PubChem (CID 58422055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).