CID 142374328

C14H29NO4Si- — CID 142374328

IUPAC—
SMILES[H]/N=C(\C(=O)OCC)C(O)C[C@H](C)O[Si-](C)(C)C(C)(C)C
InChIInChI=1S/C14H29NO4Si/c1-8-18-13(17)12(15)11(16)9-10(2)19-20(6,7)14(3,4)5/h10-11,15-16H,8-9H2,1-7H3/q-1/b15-12-/t10-,11?/m0/s1
InChIKeyKUYYSNLZUCYNFZ-INNRRAEXSA-N
MW303.48 g/mol
LogP2.73
Rot. Bonds7

About CID 142374328

CID 142374328 (PubChem CID 142374328) has the molecular formula C14H29NO4Si- and a molecular weight of 303.48 g/mol.

Molecular Properties

Compound NameCID 142374328
PubChem CID142374328
Molecular FormulaC14H29NO4Si-
Molecular Weight303.48 g/mol
Exact Mass303.19
IUPAC Name—
SMILES[H]/N=C(\C(=O)OCC)C(O)C[C@H](C)O[Si-](C)(C)C(C)(C)C
InChIInChI=1S/C14H29NO4Si/c1-8-18-13(17)12(15)11(16)9-10(2)19-20(6,7)14(3,4)5/h10-11,15-16H,8-9H2,1-7H3/q-1/b15-12-/t10-,11?/m0/s1
InChIKeyKUYYSNLZUCYNFZ-INNRRAEXSA-N
XLogP2.73
TPSA79.61 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.48
LogP ≤ 52.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

ethyl 3-fluoro-2-iminopentanoate
CID 175270794
ethyl 2-imino-3,3-dimethylbutanoate
CID 134381367
ethyl 2-amino-2-iminoacetate
CID 19017716
ethyl 2-[hydroxy(methyl)amino]-2-iminoacetate
CID 24976651
ethyl 2-imino-3-sulfanylpropanoate
CID 23182282
ethyl 3-hydroxy-5-imino-4-methyl-2-oxopentanoate
CID 91114703
ethyl 3-tert-butyl-4,4-dimethylpentanoate
CID 22372628
tert-butyl 3-ethyl-2-iminopentanoate
CID 174619481
ethyl (3E)-3-hydroxyimino-2-iminopropanoate
CID 168935813
ethyl propanoate;methane
CID 161360642
ethyl 2-oxo(213C)propanoate
CID 71309469
alumane;ethyl propanoate
CID 174257559

Frequently Asked Questions

What is the IUPAC name of CID 142374328?
The IUPAC name of CID 142374328 (CID 142374328) is not available.
What is the SMILES notation for CID 142374328?
The canonical SMILES for CID 142374328 is [H]/N=C(\C(=O)OCC)C(O)C[C@H](C)O[Si-](C)(C)C(C)(C)C.
What is the InChIKey of CID 142374328?
The InChIKey is KUYYSNLZUCYNFZ-INNRRAEXSA-N. The full InChI is InChI=1S/C14H29NO4Si/c1-8-18-13(17)12(15)11(16)9-10(2)19-20(6,7)14(3,4)5/h10-11,15-16H,8-9H2,1-7H3/q-1/b15-12-/t10-,11?/m0/s1.
What are the key properties of CID 142374328?
CID 142374328 has a molecular weight of 303.48 g/mol, XLogP of 2.73, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for CID 142374328 is sourced from PubChem (CID 142374328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).