(2Z)-2-amino-2-hydroxyimino-N-propan-2-ylacetamide

C5H11N3O2 — CID 50906522

IUPAC(2Z)-2-amino-2-hydroxyimino-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)/C(N)=N/O
InChIInChI=1S/C5H11N3O2/c1-3(2)7-5(9)4(6)8-10/h3,10H,1-2H3,(H2,6,8)(H,7,9)
InChIKeySITHLABUOSXLLI-UHFFFAOYSA-N
MW145.16 g/mol
LogP-0.74
Rot. Bonds1

About (2Z)-2-amino-2-hydroxyimino-N-propan-2-ylacetamide

(2Z)-2-amino-2-hydroxyimino-N-propan-2-ylacetamide (PubChem CID 50906522) has the molecular formula C5H11N3O2 and a molecular weight of 145.16 g/mol. Its IUPAC name is (2Z)-2-amino-2-hydroxyimino-N-propan-2-ylacetamide.

Molecular Properties

Compound Name(2Z)-2-amino-2-hydroxyimino-N-propan-2-ylacetamide
PubChem CID50906522
Molecular FormulaC5H11N3O2
Molecular Weight145.16 g/mol
Exact Mass145.09
IUPAC Name(2Z)-2-amino-2-hydroxyimino-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)/C(N)=N/O
InChIInChI=1S/C5H11N3O2/c1-3(2)7-5(9)4(6)8-10/h3,10H,1-2H3,(H2,6,8)(H,7,9)
InChIKeySITHLABUOSXLLI-UHFFFAOYSA-N
XLogP-0.74
TPSA87.71 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.16
LogP ≤ 5-0.74
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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

2-amino-2-hydroxyimino-N,N-di(propan-2-yl)acetamide
CID 60119262
2-(1-aminoethylideneamino)-N-propan-2-ylacetamide
CID 63173658
5-oxo-N-propan-2-yl-4H-1,2,4-oxadiazole-3-carboxamide
CID 137225636
CID 178949827
CID 178949827
2-(hydroxyamino)-N-methyl-2-propan-2-yliminoacetamide
CID 12015223
2-(hydroxyamino)-N-propan-2-ylacetamide
CID 12611712
N-[(1Z)-1-amino-1-hydroxyiminobutan-2-yl]acetamide
CID 14024502
(3Z)-3-amino-N-(1-amino-1-oxopropan-2-yl)-3-hydroxyiminopropanamide
CID 43545817
CID 61133336
CID 61133336
N-(1-amino-1-hydroxyiminopropan-2-yl)butanamide
CID 61134878
N-(1-amino-1-hydroxyiminopropan-2-yl)-2-methylpropanamide
CID 61134880
N-[(1Z)-1-amino-1-hydroxyiminopropan-2-yl]-N-methylacetamide
CID 61887022

Frequently Asked Questions

What is the IUPAC name of (2Z)-2-amino-2-hydroxyimino-N-propan-2-ylacetamide?
The IUPAC name of (2Z)-2-amino-2-hydroxyimino-N-propan-2-ylacetamide (CID 50906522) is (2Z)-2-amino-2-hydroxyimino-N-propan-2-ylacetamide.
What is the SMILES notation for (2Z)-2-amino-2-hydroxyimino-N-propan-2-ylacetamide?
The canonical SMILES for (2Z)-2-amino-2-hydroxyimino-N-propan-2-ylacetamide is CC(C)NC(=O)/C(N)=N/O.
What is the InChIKey of (2Z)-2-amino-2-hydroxyimino-N-propan-2-ylacetamide?
The InChIKey is SITHLABUOSXLLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11N3O2/c1-3(2)7-5(9)4(6)8-10/h3,10H,1-2H3,(H2,6,8)(H,7,9).
What are the key properties of (2Z)-2-amino-2-hydroxyimino-N-propan-2-ylacetamide?
(2Z)-2-amino-2-hydroxyimino-N-propan-2-ylacetamide has a molecular weight of 145.16 g/mol, XLogP of -0.74, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-2-amino-2-hydroxyimino-N-propan-2-ylacetamide is sourced from PubChem (CID 50906522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).