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

C10H21N3O3 — CID 103022067

IUPACN-(1-amino-1-hydroxyimino-2-methylbutan-2-yl)-2-methoxy-2-methylpropanamide
SMILESCCC(C)(NC(=O)C(C)(C)OC)C(N)=NO
InChIInChI=1S/C10H21N3O3/c1-6-10(4,7(11)13-15)12-8(14)9(2,3)16-5/h15H,6H2,1-5H3,(H2,11,13)(H,12,14)
InChIKeyKLQRKFZCZQVALP-UHFFFAOYSA-N
MW231.30 g/mol
LogP0.44
Rot. Bonds5

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

N-(1-amino-1-hydroxyimino-2-methylbutan-2-yl)-2-methoxy-2-methylpropanamide (PubChem CID 103022067) has the molecular formula C10H21N3O3 and a molecular weight of 231.30 g/mol. Its IUPAC name is N-(1-amino-1-hydroxyimino-2-methylbutan-2-yl)-2-methoxy-2-methylpropanamide.

Molecular Properties

Compound NameN-(1-amino-1-hydroxyimino-2-methylbutan-2-yl)-2-methoxy-2-methylpropanamide
PubChem CID103022067
Molecular FormulaC10H21N3O3
Molecular Weight231.30 g/mol
Exact Mass231.16
IUPAC NameN-(1-amino-1-hydroxyimino-2-methylbutan-2-yl)-2-methoxy-2-methylpropanamide
SMILESCCC(C)(NC(=O)C(C)(C)OC)C(N)=NO
InChIInChI=1S/C10H21N3O3/c1-6-10(4,7(11)13-15)12-8(14)9(2,3)16-5/h15H,6H2,1-5H3,(H2,11,13)(H,12,14)
InChIKeyKLQRKFZCZQVALP-UHFFFAOYSA-N
XLogP0.44
TPSA96.94 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.30
LogP ≤ 50.44
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-methylbutan-2-yl)-2-(2,2,2-trifluoroethoxy)acetamide
CID 113788731
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-hydroxyiminobutan-2-yl)-2-methoxy-2-methylpropanamide
CID 103022045
N-[3-(N'-hydroxycarbamimidoyl)pentan-3-yl]-2-methoxy-2-methylpropanamide
CID 103022048
N-(1-amino-1-hydroxyimino-2-methylpropan-2-yl)-2-methoxy-2-methylpropanamide
CID 103022050
N-[1-(N'-hydroxycarbamimidoyl)cyclooctyl]-2-methoxy-2-methylpropanamide
CID 103022054
N-[1-(N'-hydroxycarbamimidoyl)cyclohexyl]-2-methoxy-2-methylpropanamide
CID 103022059
N-[1-(N'-hydroxycarbamimidoyl)cycloheptyl]-2-methoxy-2-methylpropanamide
CID 103022065
N-(1-amino-1-hydroxyimino-3-methylbutan-2-yl)-2-methoxy-2-methylpropanamide
CID 103022130
N-[3-(N'-hydroxycarbamimidoyl)pentan-3-yl]-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 103940423
N-(1-amino-1-hydroxyimino-2-methylpropan-2-yl)-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 103940424

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-1-hydroxyimino-2-methylbutan-2-yl)-2-methoxy-2-methylpropanamide?
The IUPAC name of N-(1-amino-1-hydroxyimino-2-methylbutan-2-yl)-2-methoxy-2-methylpropanamide (CID 103022067) is N-(1-amino-1-hydroxyimino-2-methylbutan-2-yl)-2-methoxy-2-methylpropanamide.
What is the SMILES notation for N-(1-amino-1-hydroxyimino-2-methylbutan-2-yl)-2-methoxy-2-methylpropanamide?
The canonical SMILES for N-(1-amino-1-hydroxyimino-2-methylbutan-2-yl)-2-methoxy-2-methylpropanamide is CCC(C)(NC(=O)C(C)(C)OC)C(N)=NO.
What is the InChIKey of N-(1-amino-1-hydroxyimino-2-methylbutan-2-yl)-2-methoxy-2-methylpropanamide?
The InChIKey is KLQRKFZCZQVALP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O3/c1-6-10(4,7(11)13-15)12-8(14)9(2,3)16-5/h15H,6H2,1-5H3,(H2,11,13)(H,12,14).
What are the key properties of N-(1-amino-1-hydroxyimino-2-methylbutan-2-yl)-2-methoxy-2-methylpropanamide?
N-(1-amino-1-hydroxyimino-2-methylbutan-2-yl)-2-methoxy-2-methylpropanamide has a molecular weight of 231.30 g/mol, XLogP of 0.44, 5 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-methylpropanamide is sourced from PubChem (CID 103022067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).