N-[(1Z)-1-amino-1-hydroxyimino-2-methylpropan-2-yl]-2-methoxyacetamide

C7H15N3O3 — CID 61278179

IUPACN-[(1Z)-1-amino-1-hydroxyimino-2-methylpropan-2-yl]-2-methoxyacetamide
SMILESCOCC(=O)NC(C)(C)/C(N)=N/O
InChIInChI=1S/C7H15N3O3/c1-7(2,6(8)10-12)9-5(11)4-13-3/h12H,4H2,1-3H3,(H2,8,10)(H,9,11)
InChIKeyGJQYUUUNRKJDRM-UHFFFAOYSA-N
MW189.21 g/mol
LogP-0.73
Rot. Bonds4

About N-[(1Z)-1-amino-1-hydroxyimino-2-methylpropan-2-yl]-2-methoxyacetamide

N-[(1Z)-1-amino-1-hydroxyimino-2-methylpropan-2-yl]-2-methoxyacetamide (PubChem CID 61278179) has the molecular formula C7H15N3O3 and a molecular weight of 189.21 g/mol. Its IUPAC name is N-[(1Z)-1-amino-1-hydroxyimino-2-methylpropan-2-yl]-2-methoxyacetamide.

Molecular Properties

Compound NameN-[(1Z)-1-amino-1-hydroxyimino-2-methylpropan-2-yl]-2-methoxyacetamide
PubChem CID61278179
Molecular FormulaC7H15N3O3
Molecular Weight189.21 g/mol
Exact Mass189.11
IUPAC NameN-[(1Z)-1-amino-1-hydroxyimino-2-methylpropan-2-yl]-2-methoxyacetamide
SMILESCOCC(=O)NC(C)(C)/C(N)=N/O
InChIInChI=1S/C7H15N3O3/c1-7(2,6(8)10-12)9-5(11)4-13-3/h12H,4H2,1-3H3,(H2,8,10)(H,9,11)
InChIKeyGJQYUUUNRKJDRM-UHFFFAOYSA-N
XLogP-0.73
TPSA96.94 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.21
LogP ≤ 5-0.73
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

N-(1-amino-1-hydroxyimino-2-methylpropan-2-yl)-2-(2,2,2-trifluoroethoxy)acetamide
CID 113788730
N-[3-(N'-hydroxycarbamimidoyl)pentan-3-yl]-2-methoxyacetamide
CID 61278178
N-(1-amino-1-hydroxyimino-2-methylbutan-2-yl)-2-methoxyacetamide
CID 61278794
N-(1-amino-1-hydroxyimino-2-methylpropan-2-yl)-2-methoxyacetamide
CID 76897411
N-(1-amino-1-hydroxyimino-2-methylpropan-2-yl)-2-methoxy-2-methylpropanamide
CID 103022050
N-(1-amino-1-hydroxyimino-2-methylpropan-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 103940424
N-(1-amino-1-hydroxyimino-2-methylpropan-2-yl)-2-propan-2-yloxyacetamide
CID 103940425
N-(1-amino-1-hydroxyimino-2-methylbutan-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 103940441
N-(1-amino-1-hydroxyimino-2-methylbutan-2-yl)-2-propan-2-yloxyacetamide
CID 103940442
N-(1-amino-1-hydroxyimino-2-methylpropan-2-yl)-2-methoxypropanamide
CID 104095750
N-(1-amino-1-hydroxyimino-2-methylbutan-2-yl)-2-methoxypropanamide
CID 104095756
N-(1-amino-1-hydroxyimino-2-methylpropan-2-yl)-2-propoxyacetamide
CID 107940494

Frequently Asked Questions

What is the IUPAC name of N-[(1Z)-1-amino-1-hydroxyimino-2-methylpropan-2-yl]-2-methoxyacetamide?
The IUPAC name of N-[(1Z)-1-amino-1-hydroxyimino-2-methylpropan-2-yl]-2-methoxyacetamide (CID 61278179) is N-[(1Z)-1-amino-1-hydroxyimino-2-methylpropan-2-yl]-2-methoxyacetamide.
What is the SMILES notation for N-[(1Z)-1-amino-1-hydroxyimino-2-methylpropan-2-yl]-2-methoxyacetamide?
The canonical SMILES for N-[(1Z)-1-amino-1-hydroxyimino-2-methylpropan-2-yl]-2-methoxyacetamide is COCC(=O)NC(C)(C)/C(N)=N/O.
What is the InChIKey of N-[(1Z)-1-amino-1-hydroxyimino-2-methylpropan-2-yl]-2-methoxyacetamide?
The InChIKey is GJQYUUUNRKJDRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15N3O3/c1-7(2,6(8)10-12)9-5(11)4-13-3/h12H,4H2,1-3H3,(H2,8,10)(H,9,11).
What are the key properties of N-[(1Z)-1-amino-1-hydroxyimino-2-methylpropan-2-yl]-2-methoxyacetamide?
N-[(1Z)-1-amino-1-hydroxyimino-2-methylpropan-2-yl]-2-methoxyacetamide has a molecular weight of 189.21 g/mol, XLogP of -0.73, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1Z)-1-amino-1-hydroxyimino-2-methylpropan-2-yl]-2-methoxyacetamide is sourced from PubChem (CID 61278179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).