2-[tert-butyl(hydroxy)amino]-N,2-dimethylpropanamide

C9H20N2O2 — CID 23563826

IUPAC2-[tert-butyl(hydroxy)amino]-N,2-dimethylpropanamide
SMILESCNC(=O)C(C)(C)N(O)C(C)(C)C
InChIInChI=1S/C9H20N2O2/c1-8(2,3)11(13)9(4,5)7(12)10-6/h13H,1-6H3,(H,10,12)
InChIKeyXWTQKLMXCQESRL-UHFFFAOYSA-N
MW188.27 g/mol
LogP1.00
Rot. Bonds2

About 2-[tert-butyl(hydroxy)amino]-N,2-dimethylpropanamide

2-[tert-butyl(hydroxy)amino]-N,2-dimethylpropanamide (PubChem CID 23563826) has the molecular formula C9H20N2O2 and a molecular weight of 188.27 g/mol. Its IUPAC name is 2-[tert-butyl(hydroxy)amino]-N,2-dimethylpropanamide.

Molecular Properties

Compound Name2-[tert-butyl(hydroxy)amino]-N,2-dimethylpropanamide
PubChem CID23563826
Molecular FormulaC9H20N2O2
Molecular Weight188.27 g/mol
Exact Mass188.15
IUPAC Name2-[tert-butyl(hydroxy)amino]-N,2-dimethylpropanamide
SMILESCNC(=O)C(C)(C)N(O)C(C)(C)C
InChIInChI=1S/C9H20N2O2/c1-8(2,3)11(13)9(4,5)7(12)10-6/h13H,1-6H3,(H,10,12)
InChIKeyXWTQKLMXCQESRL-UHFFFAOYSA-N
XLogP1.00
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(2R)-2-[(2-acetamidoacetyl)amino]-N-tert-butyl-N-hydroxypropanamide
CID 154721504
2-(tert-butylamino)-N,2-dimethylpropanamide
CID 10057993
2-[2-aminopropanoyl(methyl)amino]-N-hydroxy-2-methylpropanamide
CID 18729338
Tert-butyl-(dimethyl-tert-butylaminocarbonyl-methyl)-hydroxylamine
CID 22182216
N-(cyano-isopropyloxy)-tert-butyl-(dimethyl-methylaminocarbonyl-methyl)-amine
CID 22598524
2-[tert-butyl(hydroxy)amino]-N,N,2-trimethylpropanamide
CID 22598527
N-butyl-2-[tert-butyl(hydroxy)amino]-2-methylpropanamide
CID 23563828
N-methoxy-N,2-dimethyl-2-(methylamino)propanamide
CID 54116615
N-[2-(hydroxyamino)-2-methylpropyl]butanamide
CID 58654641
2-[tert-butyl(hydroxy)amino]-N-propan-2-ylacetamide
CID 58691090
CID 59039616
CID 59039616
CID 59039618
CID 59039618

Frequently Asked Questions

What is the IUPAC name of 2-[tert-butyl(hydroxy)amino]-N,2-dimethylpropanamide?
The IUPAC name of 2-[tert-butyl(hydroxy)amino]-N,2-dimethylpropanamide (CID 23563826) is 2-[tert-butyl(hydroxy)amino]-N,2-dimethylpropanamide.
What is the SMILES notation for 2-[tert-butyl(hydroxy)amino]-N,2-dimethylpropanamide?
The canonical SMILES for 2-[tert-butyl(hydroxy)amino]-N,2-dimethylpropanamide is CNC(=O)C(C)(C)N(O)C(C)(C)C.
What is the InChIKey of 2-[tert-butyl(hydroxy)amino]-N,2-dimethylpropanamide?
The InChIKey is XWTQKLMXCQESRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O2/c1-8(2,3)11(13)9(4,5)7(12)10-6/h13H,1-6H3,(H,10,12).
What are the key properties of 2-[tert-butyl(hydroxy)amino]-N,2-dimethylpropanamide?
2-[tert-butyl(hydroxy)amino]-N,2-dimethylpropanamide has a molecular weight of 188.27 g/mol, XLogP of 1.00, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[tert-butyl(hydroxy)amino]-N,2-dimethylpropanamide is sourced from PubChem (CID 23563826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).