N-hydroxy-N',N'-dimethylpropanediamide

C5H10N2O3 — CID 131155759

IUPACN-hydroxy-N',N'-dimethylpropanediamide
SMILESCN(C)C(=O)CC(=O)NO
InChIInChI=1S/C5H10N2O3/c1-7(2)5(9)3-4(8)6-10/h10H,3H2,1-2H3,(H,6,8)
InChIKeyDNDFOKKPMXNPDX-UHFFFAOYSA-N
MW146.15 g/mol
LogP-1.03
Rot. Bonds2

About N-hydroxy-N',N'-dimethylpropanediamide

N-hydroxy-N',N'-dimethylpropanediamide (PubChem CID 131155759) has the molecular formula C5H10N2O3 and a molecular weight of 146.15 g/mol. Its IUPAC name is N-hydroxy-N',N'-dimethylpropanediamide.

Molecular Properties

Compound NameN-hydroxy-N',N'-dimethylpropanediamide
PubChem CID131155759
Molecular FormulaC5H10N2O3
Molecular Weight146.15 g/mol
Exact Mass146.07
IUPAC NameN-hydroxy-N',N'-dimethylpropanediamide
SMILESCN(C)C(=O)CC(=O)NO
InChIInChI=1S/C5H10N2O3/c1-7(2)5(9)3-4(8)6-10/h10H,3H2,1-2H3,(H,6,8)
InChIKeyDNDFOKKPMXNPDX-UHFFFAOYSA-N
XLogP-1.03
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.15
LogP ≤ 5-1.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-hydroxy-N',N'-dimethylpropanediamide?
The IUPAC name of N-hydroxy-N',N'-dimethylpropanediamide (CID 131155759) is N-hydroxy-N',N'-dimethylpropanediamide.
What is the SMILES notation for N-hydroxy-N',N'-dimethylpropanediamide?
The canonical SMILES for N-hydroxy-N',N'-dimethylpropanediamide is CN(C)C(=O)CC(=O)NO.
What is the InChIKey of N-hydroxy-N',N'-dimethylpropanediamide?
The InChIKey is DNDFOKKPMXNPDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2O3/c1-7(2)5(9)3-4(8)6-10/h10H,3H2,1-2H3,(H,6,8).
What are the key properties of N-hydroxy-N',N'-dimethylpropanediamide?
N-hydroxy-N',N'-dimethylpropanediamide has a molecular weight of 146.15 g/mol, XLogP of -1.03, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-N',N'-dimethylpropanediamide is sourced from PubChem (CID 131155759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).