N-(1-amino-1-hydroxyimino-2-methylbutan-2-yl)-2-methoxy-2-methylbutanamide

C11H23N3O3 — CID 114106266

IUPACN-(1-amino-1-hydroxyimino-2-methylbutan-2-yl)-2-methoxy-2-methylbutanamide
SMILESCCC(C)(NC(=O)C(C)(CC)OC)C(N)=NO
InChIInChI=1S/C11H23N3O3/c1-6-10(3,8(12)14-16)13-9(15)11(4,7-2)17-5/h16H,6-7H2,1-5H3,(H2,12,14)(H,13,15)
InChIKeyAJCYVXLDDDZDSD-UHFFFAOYSA-N
MW245.32 g/mol
LogP0.83
Rot. Bonds6

About N-(1-amino-1-hydroxyimino-2-methylbutan-2-yl)-2-methoxy-2-methylbutanamide

N-(1-amino-1-hydroxyimino-2-methylbutan-2-yl)-2-methoxy-2-methylbutanamide (PubChem CID 114106266) has the molecular formula C11H23N3O3 and a molecular weight of 245.32 g/mol. Its IUPAC name is N-(1-amino-1-hydroxyimino-2-methylbutan-2-yl)-2-methoxy-2-methylbutanamide.

Molecular Properties

Compound NameN-(1-amino-1-hydroxyimino-2-methylbutan-2-yl)-2-methoxy-2-methylbutanamide
PubChem CID114106266
Molecular FormulaC11H23N3O3
Molecular Weight245.32 g/mol
Exact Mass245.17
IUPAC NameN-(1-amino-1-hydroxyimino-2-methylbutan-2-yl)-2-methoxy-2-methylbutanamide
SMILESCCC(C)(NC(=O)C(C)(CC)OC)C(N)=NO
InChIInChI=1S/C11H23N3O3/c1-6-10(3,8(12)14-16)13-9(15)11(4,7-2)17-5/h16H,6-7H2,1-5H3,(H2,12,14)(H,13,15)
InChIKeyAJCYVXLDDDZDSD-UHFFFAOYSA-N
XLogP0.83
TPSA96.94 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.32
LogP ≤ 50.83
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

3-(1-amino-1-hydroxyimino-2-methylbutan-2-yl)-1,1-dimethylurea
CID 79154540
3-[(2-methoxy-2-methylbutanoyl)amino]-2,2,3-trimethylbutanoic acid
CID 114105249
N-(1-amino-1-hydroxyimino-2-methylbutan-2-yl)-4-tert-butylthiadiazole-5-carboxamide
CID 77059738
N-(1-amino-1-hydroxyimino-2-methylbutan-2-yl)morpholine-4-carboxamide
CID 79152780
N-[(1Z)-1-amino-1-hydroxyimino-2-methylbutan-2-yl]-3-bromo-4-methylbenzamide
CID 81476900
2-(tert-butylsulfonylamino)-N'-hydroxy-2-methylbutanimidamide
CID 77017138
N-[(1Z)-1-amino-1-hydroxyimino-2-methylbutan-2-yl]-4-chloro-3-fluorobenzamide
CID 107992396
2-[(2-methoxy-2-methylpropanoyl)amino]-2-methylbutanoic acid
CID 103018984
N-(1-amino-1-hydroxyimino-2-methylbutan-2-yl)-1-methyltriazole-4-carboxamide
CID 112735696
N-(1-amino-1-hydroxyimino-2-methylbutan-2-yl)-2-methyloxolane-3-carboxamide
CID 79762996
(NE)-N-(3-methoxy-3-methylpentan-2-ylidene)hydroxylamine
CID 10606878
N-(1-amino-1-hydroxyimino-2-methylbutan-2-yl)-3-ethyl-6-methylpyridazine-4-carboxamide
CID 104671954

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-1-hydroxyimino-2-methylbutan-2-yl)-2-methoxy-2-methylbutanamide?
The IUPAC name of N-(1-amino-1-hydroxyimino-2-methylbutan-2-yl)-2-methoxy-2-methylbutanamide (CID 114106266) is N-(1-amino-1-hydroxyimino-2-methylbutan-2-yl)-2-methoxy-2-methylbutanamide.
What is the SMILES notation for N-(1-amino-1-hydroxyimino-2-methylbutan-2-yl)-2-methoxy-2-methylbutanamide?
The canonical SMILES for N-(1-amino-1-hydroxyimino-2-methylbutan-2-yl)-2-methoxy-2-methylbutanamide is CCC(C)(NC(=O)C(C)(CC)OC)C(N)=NO.
What is the InChIKey of N-(1-amino-1-hydroxyimino-2-methylbutan-2-yl)-2-methoxy-2-methylbutanamide?
The InChIKey is AJCYVXLDDDZDSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O3/c1-6-10(3,8(12)14-16)13-9(15)11(4,7-2)17-5/h16H,6-7H2,1-5H3,(H2,12,14)(H,13,15).
What are the key properties of N-(1-amino-1-hydroxyimino-2-methylbutan-2-yl)-2-methoxy-2-methylbutanamide?
N-(1-amino-1-hydroxyimino-2-methylbutan-2-yl)-2-methoxy-2-methylbutanamide has a molecular weight of 245.32 g/mol, XLogP of 0.83, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-1-hydroxyimino-2-methylbutan-2-yl)-2-methoxy-2-methylbutanamide is sourced from PubChem (CID 114106266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).