(2R)-2-[tert-butyl(dimethyl)silyl]oxy-4-hydroxy-N-methoxy-N,3,3-trimethylbutanamide

C14H31NO4Si — CID 11109525

IUPAC(2R)-2-[tert-butyl(dimethyl)silyl]oxy-4-hydroxy-N-methoxy-N,3,3-trimethylbutanamide
SMILESCON(C)C(=O)[C@H](O[Si](C)(C)C(C)(C)C)C(C)(C)CO
InChIInChI=1S/C14H31NO4Si/c1-13(2,3)20(8,9)19-11(14(4,5)10-16)12(17)15(6)18-7/h11,16H,10H2,1-9H3/t11-/m0/s1
InChIKeyNDJKCIIXSGSNDB-NSHDSACASA-N
MW305.49 g/mol
LogP2.42
Rot. Bonds6

About (2R)-2-[tert-butyl(dimethyl)silyl]oxy-4-hydroxy-N-methoxy-N,3,3-trimethylbutanamide

(2R)-2-[tert-butyl(dimethyl)silyl]oxy-4-hydroxy-N-methoxy-N,3,3-trimethylbutanamide (PubChem CID 11109525) has the molecular formula C14H31NO4Si and a molecular weight of 305.49 g/mol. Its IUPAC name is (2R)-2-[tert-butyl(dimethyl)silyl]oxy-4-hydroxy-N-methoxy-N,3,3-trimethylbutanamide.

Molecular Properties

Compound Name(2R)-2-[tert-butyl(dimethyl)silyl]oxy-4-hydroxy-N-methoxy-N,3,3-trimethylbutanamide
PubChem CID11109525
Molecular FormulaC14H31NO4Si
Molecular Weight305.49 g/mol
Exact Mass305.20
IUPAC Name(2R)-2-[tert-butyl(dimethyl)silyl]oxy-4-hydroxy-N-methoxy-N,3,3-trimethylbutanamide
SMILESCON(C)C(=O)[C@H](O[Si](C)(C)C(C)(C)C)C(C)(C)CO
InChIInChI=1S/C14H31NO4Si/c1-13(2,3)20(8,9)19-11(14(4,5)10-16)12(17)15(6)18-7/h11,16H,10H2,1-9H3/t11-/m0/s1
InChIKeyNDJKCIIXSGSNDB-NSHDSACASA-N
XLogP2.42
TPSA59.00 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.49
LogP ≤ 52.42
H-Bond Donors ≤ 51
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'}

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Related Compounds

3-[tert-butyl(dimethyl)silyl]oxy-N-methoxy-N,2,4-trimethyl-5-oxopentanamide
CID 18678788
(4R)-4-[tert-butyl(dimethyl)silyl]oxy-N-methoxy-N,2-dimethyl-7-oxoheptanamide
CID 58077726
(2R)-2-[tert-butyl(dimethyl)silyl]oxypropanoic acid
CID 14358757
tert-butyl N-[3-[tert-butyl(dimethyl)silyl]oxy-1-[methoxy(methyl)amino]-1-oxopropan-2-yl]-N-methylcarbamate
CID 59656752
(2R,3S,4R,7S)-3-[tert-butyl(dimethyl)silyl]oxy-7-hydroxy-N-methoxy-N,2,4,9-tetramethyl-5-oxodec-8-enamide
CID 11281464
(E,4S)-4-[tert-butyl(dimethyl)silyl]oxy-6-hydroxy-5,5-dimethylhex-2-enoic acid
CID 87423006
(2R)-2-[tert-butyl(dimethyl)silyl]oxy-N-[3-[2-[2-[[3-[[(2R)-2-[tert-butyl(dimethyl)silyl]oxy-4-hydroxy-3,3-dimethylbutanoyl]amino]-3-oxopropyl]amino]ethyldisulfanyl]ethylamino]propanoyl]-4-hydroxy-3,3-dimethylbutanamide
CID 162512972
(2S,3R,6S,8S,9R,10S)-3-[tert-butyl(dimethyl)silyl]oxy-9-hydroxy-N-methoxy-N,2,6,8,10-pentamethyldodec-11-ynamide
CID 66572021
(E,2S)-2-[(E,1S)-1-[tert-butyl(dimethyl)silyl]oxy-3-iodoprop-2-enyl]-7-chloro-N-methoxy-N,6-dimethylhept-5-enamide
CID 25128578
(3S)-3-[tert-butyl(dimethyl)silyl]oxy-5-hydroxypentan-2-one
CID 10633359
4-[tert-butyl(dimethyl)silyl]oxyheptane-2,6-dione
CID 123783100
(3S)-1,1-dibromo-3-[tert-butyl(dimethyl)silyl]oxybutan-2-one
CID 10970420

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[tert-butyl(dimethyl)silyl]oxy-4-hydroxy-N-methoxy-N,3,3-trimethylbutanamide?
The IUPAC name of (2R)-2-[tert-butyl(dimethyl)silyl]oxy-4-hydroxy-N-methoxy-N,3,3-trimethylbutanamide (CID 11109525) is (2R)-2-[tert-butyl(dimethyl)silyl]oxy-4-hydroxy-N-methoxy-N,3,3-trimethylbutanamide.
What is the SMILES notation for (2R)-2-[tert-butyl(dimethyl)silyl]oxy-4-hydroxy-N-methoxy-N,3,3-trimethylbutanamide?
The canonical SMILES for (2R)-2-[tert-butyl(dimethyl)silyl]oxy-4-hydroxy-N-methoxy-N,3,3-trimethylbutanamide is CON(C)C(=O)[C@H](O[Si](C)(C)C(C)(C)C)C(C)(C)CO.
What is the InChIKey of (2R)-2-[tert-butyl(dimethyl)silyl]oxy-4-hydroxy-N-methoxy-N,3,3-trimethylbutanamide?
The InChIKey is NDJKCIIXSGSNDB-NSHDSACASA-N. The full InChI is InChI=1S/C14H31NO4Si/c1-13(2,3)20(8,9)19-11(14(4,5)10-16)12(17)15(6)18-7/h11,16H,10H2,1-9H3/t11-/m0/s1.
What are the key properties of (2R)-2-[tert-butyl(dimethyl)silyl]oxy-4-hydroxy-N-methoxy-N,3,3-trimethylbutanamide?
(2R)-2-[tert-butyl(dimethyl)silyl]oxy-4-hydroxy-N-methoxy-N,3,3-trimethylbutanamide has a molecular weight of 305.49 g/mol, XLogP of 2.42, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[tert-butyl(dimethyl)silyl]oxy-4-hydroxy-N-methoxy-N,3,3-trimethylbutanamide is sourced from PubChem (CID 11109525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).