CID 170586865

C11H21NO4Si — CID 170586865

IUPAC—
SMILESCON(C)C(=O)[Si][C@@H](C)CC(=O)OC(C)(C)C
InChIInChI=1S/C11H21NO4Si/c1-8(17-10(14)12(5)15-6)7-9(13)16-11(2,3)4/h8H,7H2,1-6H3/t8-/m0/s1
InChIKeyKKLGZFJBVYHJCJ-QMMMGPOBSA-N
MW259.38 g/mol
LogP1.84
Rot. Bonds5

About CID 170586865

CID 170586865 (PubChem CID 170586865) has the molecular formula C11H21NO4Si and a molecular weight of 259.38 g/mol.

Molecular Properties

Compound NameCID 170586865
PubChem CID170586865
Molecular FormulaC11H21NO4Si
Molecular Weight259.38 g/mol
Exact Mass259.12
IUPAC Name—
SMILESCON(C)C(=O)[Si][C@@H](C)CC(=O)OC(C)(C)C
InChIInChI=1S/C11H21NO4Si/c1-8(17-10(14)12(5)15-6)7-9(13)16-11(2,3)4/h8H,7H2,1-6H3/t8-/m0/s1
InChIKeyKKLGZFJBVYHJCJ-QMMMGPOBSA-N
XLogP1.84
TPSA55.84 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.38
LogP ≤ 51.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze CID 170586865 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

tert-butyl 4-[methoxy(methyl)amino]-3-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-4-oxobutanoate
CID 88965705
tert-butyl (3R)-3,4,4-trimethylpentanoate
CID 89006070
tert-butyl 3,3-diaminopropanoate
CID 57031897
tert-butyl (3R,4S)-4-[chloro(methyl)amino]-3-methoxypentanoate
CID 89318052
CID 20745570
CID 20745570
tert-butyl N-[(2R)-1-hydroxypropan-2-yl]-N-methylcarbamate
CID 131045912
tert-butyl 2-amino-4-[methoxy(methyl)amino]-4-oxobutanoate
CID 90348684
tert-butyl (3R)-3-methylpentanoate
CID 158245009
ditert-butyl (2S)-2-aminobutanedioate;ditert-butyl (2R)-2-aminobutanedioate
CID 163821206
tert-butyl (3S)-3-(methoxymethyl)-4-methylpentanoate
CID 123336860
tert-butyl (3S)-3,4-diamino-4-oxobutanoate
CID 7019655
tert-butyl (3S)-3-amino-4,4-dihydroxybutanoate
CID 139456392

Frequently Asked Questions

What is the IUPAC name of CID 170586865?
The IUPAC name of CID 170586865 (CID 170586865) is not available.
What is the SMILES notation for CID 170586865?
The canonical SMILES for CID 170586865 is CON(C)C(=O)[Si][C@@H](C)CC(=O)OC(C)(C)C.
What is the InChIKey of CID 170586865?
The InChIKey is KKLGZFJBVYHJCJ-QMMMGPOBSA-N. The full InChI is InChI=1S/C11H21NO4Si/c1-8(17-10(14)12(5)15-6)7-9(13)16-11(2,3)4/h8H,7H2,1-6H3/t8-/m0/s1.
What are the key properties of CID 170586865?
CID 170586865 has a molecular weight of 259.38 g/mol, XLogP of 1.84, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for CID 170586865 is sourced from PubChem (CID 170586865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).