2-aminooxydodecanehydrazide

C12H27N3O2 — CID 19105405

IUPAC2-aminooxydodecanehydrazide
SMILESCCCCCCCCCCC(ON)C(=O)NN
InChIInChI=1S/C12H27N3O2/c1-2-3-4-5-6-7-8-9-10-11(17-14)12(16)15-13/h11H,2-10,13-14H2,1H3,(H,15,16)
InChIKeyNQFKIKWQWGWKJD-UHFFFAOYSA-N
MW245.37 g/mol
LogP1.77
Rot. Bonds11

About 2-aminooxydodecanehydrazide

2-aminooxydodecanehydrazide (PubChem CID 19105405) has the molecular formula C12H27N3O2 and a molecular weight of 245.37 g/mol. Its IUPAC name is 2-aminooxydodecanehydrazide.

Molecular Properties

Compound Name2-aminooxydodecanehydrazide
PubChem CID19105405
Molecular FormulaC12H27N3O2
Molecular Weight245.37 g/mol
Exact Mass245.21
IUPAC Name2-aminooxydodecanehydrazide
SMILESCCCCCCCCCCC(ON)C(=O)NN
InChIInChI=1S/C12H27N3O2/c1-2-3-4-5-6-7-8-9-10-11(17-14)12(16)15-13/h11H,2-10,13-14H2,1H3,(H,15,16)
InChIKeyNQFKIKWQWGWKJD-UHFFFAOYSA-N
XLogP1.77
TPSA90.37 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.37
LogP ≤ 51.77
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-aminooxyheptanoic acid
CID 88524492
2-octan-2-yloxybutanehydrazide
CID 63574494
2-hexoxy-3-methoxypropanehydrazide
CID 103229247
(2R)-2-(4-nitrophenoxy)tetradecanehydrazide
CID 95240315
2-octylbutanedihydrazide
CID 19764915
methyl 2-methoxyheptanoate
CID 87952097
2-dodecyl-N-(2-dodecyltetradecanoylamino)oxytetradecanamide
CID 173246682
dimethyl 2-dodecylpropanedioate
CID 158514957
dimethyl 2,3-dihexadecylbutanedioate
CID 141293335
methyl 2-undecyltridecanoate
CID 176610383
2-ethoxyoctanamide
CID 174492663
methyl (3S)-3-aminotetradecanoate
CID 162514819

Frequently Asked Questions

What is the IUPAC name of 2-aminooxydodecanehydrazide?
The IUPAC name of 2-aminooxydodecanehydrazide (CID 19105405) is 2-aminooxydodecanehydrazide.
What is the SMILES notation for 2-aminooxydodecanehydrazide?
The canonical SMILES for 2-aminooxydodecanehydrazide is CCCCCCCCCCC(ON)C(=O)NN.
What is the InChIKey of 2-aminooxydodecanehydrazide?
The InChIKey is NQFKIKWQWGWKJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H27N3O2/c1-2-3-4-5-6-7-8-9-10-11(17-14)12(16)15-13/h11H,2-10,13-14H2,1H3,(H,15,16).
What are the key properties of 2-aminooxydodecanehydrazide?
2-aminooxydodecanehydrazide has a molecular weight of 245.37 g/mol, XLogP of 1.77, 11 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-aminooxydodecanehydrazide is sourced from PubChem (CID 19105405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).