N-[3-[3-[3-(hydroxyamino)propoxy]propoxy]propyl]acetamide

C11H24N2O4 — CID 20655076

IUPACN-[3-[3-[3-(hydroxyamino)propoxy]propoxy]propyl]acetamide
SMILESCC(=O)NCCCOCCCOCCCNO
InChIInChI=1S/C11H24N2O4/c1-11(14)12-5-2-7-16-9-4-10-17-8-3-6-13-15/h13,15H,2-10H2,1H3,(H,12,14)
InChIKeyHBUZAJYHONLVCO-UHFFFAOYSA-N
MW248.32 g/mol
LogP0.30
Rot. Bonds12

About N-[3-[3-[3-(hydroxyamino)propoxy]propoxy]propyl]acetamide

N-[3-[3-[3-(hydroxyamino)propoxy]propoxy]propyl]acetamide (PubChem CID 20655076) has the molecular formula C11H24N2O4 and a molecular weight of 248.32 g/mol. Its IUPAC name is N-[3-[3-[3-(hydroxyamino)propoxy]propoxy]propyl]acetamide.

Molecular Properties

Compound NameN-[3-[3-[3-(hydroxyamino)propoxy]propoxy]propyl]acetamide
PubChem CID20655076
Molecular FormulaC11H24N2O4
Molecular Weight248.32 g/mol
Exact Mass248.17
IUPAC NameN-[3-[3-[3-(hydroxyamino)propoxy]propoxy]propyl]acetamide
SMILESCC(=O)NCCCOCCCOCCCNO
InChIInChI=1S/C11H24N2O4/c1-11(14)12-5-2-7-16-9-4-10-17-8-3-6-13-15/h13,15H,2-10H2,1H3,(H,12,14)
InChIKeyHBUZAJYHONLVCO-UHFFFAOYSA-N
XLogP0.30
TPSA79.82 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds12
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.32
LogP ≤ 50.30
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-[3-(2-methoxyethoxy)propyl]acetamide
CID 60668585
ethane;N-[3-(2-methoxyethoxy)propyl]acetamide
CID 177221846
N-[3-(2-ethoxyethoxy)propyl]acetamide
CID 129212456
N-[4-(3-methoxypropoxy)butyl]acetamide
CID 134356384
N-[3-[2-[2-(3-acetamidopropoxy)ethoxy]ethoxy]propyl]butanamide
CID 121313484
N-[2-[2-(2-acetamidoethoxy)ethoxy]ethyl]acetamide
CID 18674787
N'-(2-acetamidoethyl)-N-(3-ethoxypropyl)oxamide
CID 108505337
N-[3-[2-[2-(3-acetamidopropoxy)ethoxy]ethoxy]propyl]-6-oxoheptanamide
CID 142462796
N-(3-acetamidopropyl)acetamide
CID 5147555
N-[2-(3-propoxypropylamino)ethyl]acetamide
CID 107529829
N-[3-(propylaminooxy)propyl]acetamide
CID 155215275
N-[2-(2-butoxyethoxy)ethyl]acetamide;ethane
CID 163393772

Frequently Asked Questions

What is the IUPAC name of N-[3-[3-[3-(hydroxyamino)propoxy]propoxy]propyl]acetamide?
The IUPAC name of N-[3-[3-[3-(hydroxyamino)propoxy]propoxy]propyl]acetamide (CID 20655076) is N-[3-[3-[3-(hydroxyamino)propoxy]propoxy]propyl]acetamide.
What is the SMILES notation for N-[3-[3-[3-(hydroxyamino)propoxy]propoxy]propyl]acetamide?
The canonical SMILES for N-[3-[3-[3-(hydroxyamino)propoxy]propoxy]propyl]acetamide is CC(=O)NCCCOCCCOCCCNO.
What is the InChIKey of N-[3-[3-[3-(hydroxyamino)propoxy]propoxy]propyl]acetamide?
The InChIKey is HBUZAJYHONLVCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O4/c1-11(14)12-5-2-7-16-9-4-10-17-8-3-6-13-15/h13,15H,2-10H2,1H3,(H,12,14).
What are the key properties of N-[3-[3-[3-(hydroxyamino)propoxy]propoxy]propyl]acetamide?
N-[3-[3-[3-(hydroxyamino)propoxy]propoxy]propyl]acetamide has a molecular weight of 248.32 g/mol, XLogP of 0.30, 12 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[3-[3-(hydroxyamino)propoxy]propoxy]propyl]acetamide is sourced from PubChem (CID 20655076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).