2-[(2-dimethylphosphorylacetyl)amino]-N-hydroxy-N-propan-2-ylacetamide;ethane

C15H37N2O4P — CID 142100543

IUPAC2-[(2-dimethylphosphorylacetyl)amino]-N-hydroxy-N-propan-2-ylacetamide;ethane
SMILESCC.CC.CC.CC(C)N(O)C(=O)CNC(=O)CP(C)(C)=O
InChIInChI=1S/C9H19N2O4P.3C2H6/c1-7(2)11(14)9(13)5-10-8(12)6-16(3,4)15;3*1-2/h7,14H,5-6H2,1-4H3,(H,10,12);3*1-2H3
InChIKeyDYPRVPDCPUHRIV-UHFFFAOYSA-N
MW340.45 g/mol
LogP3.43
Rot. Bonds5

About 2-[(2-dimethylphosphorylacetyl)amino]-N-hydroxy-N-propan-2-ylacetamide;ethane

2-[(2-dimethylphosphorylacetyl)amino]-N-hydroxy-N-propan-2-ylacetamide;ethane (PubChem CID 142100543) has the molecular formula C15H37N2O4P and a molecular weight of 340.45 g/mol. Its IUPAC name is 2-[(2-dimethylphosphorylacetyl)amino]-N-hydroxy-N-propan-2-ylacetamide;ethane.

Molecular Properties

Compound Name2-[(2-dimethylphosphorylacetyl)amino]-N-hydroxy-N-propan-2-ylacetamide;ethane
PubChem CID142100543
Molecular FormulaC15H37N2O4P
Molecular Weight340.45 g/mol
Exact Mass340.25
IUPAC Name2-[(2-dimethylphosphorylacetyl)amino]-N-hydroxy-N-propan-2-ylacetamide;ethane
SMILESCC.CC.CC.CC(C)N(O)C(=O)CNC(=O)CP(C)(C)=O
InChIInChI=1S/C9H19N2O4P.3C2H6/c1-7(2)11(14)9(13)5-10-8(12)6-16(3,4)15;3*1-2/h7,14H,5-6H2,1-4H3,(H,10,12);3*1-2H3
InChIKeyDYPRVPDCPUHRIV-UHFFFAOYSA-N
XLogP3.43
TPSA86.71 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.45
LogP ≤ 53.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-dimethylphosphoryl-N-hydroxy-N-propan-2-ylbutanamide
CID 142080859
ethane;2-[hydroxy-[2-[[hydroxy(methyl)phosphoryl]methylamino]acetyl]amino]propanoic acid
CID 142100445
2-amino-N-[2-[methyl(propan-2-yl)amino]-2-oxoethyl]acetamide
CID 60847744
1-dimethylphosphoryl-4-methylpentan-2-one
CID 20584312
[2-[[2-[anilinomethyl(hydroxy)amino]-2-oxoethyl]amino]-2-oxoethyl]-methylphosphinic acid
CID 142100346
2-[[2-[(2-acetamidoacetyl)amino]acetyl]-propan-2-ylamino]acetic acid
CID 119198762
3-[[2-(3,3-dimethylbutanoylamino)acetyl]-(2-methylpropyl)amino]propanoic acid
CID 119190598
5-[[2-(dimethylamino)-2-oxoethyl]amino]-3-methyl-5-oxopentanoic acid
CID 62963822
N-[2-(dimethylamino)-2-oxoethyl]-3-methyl-2-(methylamino)butanamide;ethane
CID 162738491
(3R)-N-[2-(dimethylamino)-2-oxoethyl]-3,5-dimethylhexanamide
CID 95211996
N-[2-(dimethylamino)-2-oxoethyl]-4-pyrrolidin-1-ylpentanamide
CID 131892803
CID 58960279
CID 58960279

Frequently Asked Questions

What is the IUPAC name of 2-[(2-dimethylphosphorylacetyl)amino]-N-hydroxy-N-propan-2-ylacetamide;ethane?
The IUPAC name of 2-[(2-dimethylphosphorylacetyl)amino]-N-hydroxy-N-propan-2-ylacetamide;ethane (CID 142100543) is 2-[(2-dimethylphosphorylacetyl)amino]-N-hydroxy-N-propan-2-ylacetamide;ethane.
What is the SMILES notation for 2-[(2-dimethylphosphorylacetyl)amino]-N-hydroxy-N-propan-2-ylacetamide;ethane?
The canonical SMILES for 2-[(2-dimethylphosphorylacetyl)amino]-N-hydroxy-N-propan-2-ylacetamide;ethane is CC.CC.CC.CC(C)N(O)C(=O)CNC(=O)CP(C)(C)=O.
What is the InChIKey of 2-[(2-dimethylphosphorylacetyl)amino]-N-hydroxy-N-propan-2-ylacetamide;ethane?
The InChIKey is DYPRVPDCPUHRIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19N2O4P.3C2H6/c1-7(2)11(14)9(13)5-10-8(12)6-16(3,4)15;3*1-2/h7,14H,5-6H2,1-4H3,(H,10,12);3*1-2H3.
What are the key properties of 2-[(2-dimethylphosphorylacetyl)amino]-N-hydroxy-N-propan-2-ylacetamide;ethane?
2-[(2-dimethylphosphorylacetyl)amino]-N-hydroxy-N-propan-2-ylacetamide;ethane has a molecular weight of 340.45 g/mol, XLogP of 3.43, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-dimethylphosphorylacetyl)amino]-N-hydroxy-N-propan-2-ylacetamide;ethane is sourced from PubChem (CID 142100543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).