1-[[hydrazinylmethyl(methyl)-λ3-iodanyl]amino]oxypropane

C5H16IN3O — CID 163628054

IUPAC1-[[hydrazinylmethyl(methyl)-λ3-iodanyl]amino]oxypropane
SMILESCCCONI(C)CNN
InChIInChI=1S/C5H16IN3O/c1-3-4-10-9-6(2)5-8-7/h8-9H,3-5,7H2,1-2H3
InChIKeyHTRMAEKBQVFPBK-UHFFFAOYSA-N
MW261.11 g/mol
LogP0.39
Rot. Bonds6

About 1-[[hydrazinylmethyl(methyl)-λ3-iodanyl]amino]oxypropane

1-[[hydrazinylmethyl(methyl)-λ3-iodanyl]amino]oxypropane (PubChem CID 163628054) has the molecular formula C5H16IN3O and a molecular weight of 261.11 g/mol. Its IUPAC name is 1-[[hydrazinylmethyl(methyl)-λ3-iodanyl]amino]oxypropane.

Molecular Properties

Compound Name1-[[hydrazinylmethyl(methyl)-λ3-iodanyl]amino]oxypropane
PubChem CID163628054
Molecular FormulaC5H16IN3O
Molecular Weight261.11 g/mol
Exact Mass261.03
IUPAC Name1-[[hydrazinylmethyl(methyl)-λ3-iodanyl]amino]oxypropane
SMILESCCCONI(C)CNN
InChIInChI=1S/C5H16IN3O/c1-3-4-10-9-6(2)5-8-7/h8-9H,3-5,7H2,1-2H3
InChIKeyHTRMAEKBQVFPBK-UHFFFAOYSA-N
XLogP0.39
TPSA59.31 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.11
LogP ≤ 50.39
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'N-C-halo', 'substructure': 'N/A'}

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Related Compounds

1,2-dipropoxyhydrazine
CID 151105951
1-(methylsulfanylamino)oxypropane
CID 130298845
1-(iodoamino)oxypropane
CID 88548400
1-(1,2,2-tripropoxyethenoxy)propane
CID 12561622
2-amino-1-propoxyguanidine
CID 130609787
2-(propoxyamino)guanidine
CID 118626334
2-propoxypropylhydrazine
CID 166866965
2-N-propoxy-4-N,6-N-dipropyl-1,3,5-triazine-2,4,6-triamine
CID 123408830
methyl 2-oxo-2-(propoxyamino)acetate
CID 15007507
N-propoxyprop-1-en-1-amine
CID 76504451
1-propoxyethenylhydrazine
CID 157287762
1-[hydrazinyl(methyl)amino]oxypropane
CID 163560819

Frequently Asked Questions

What is the IUPAC name of 1-[[hydrazinylmethyl(methyl)-λ3-iodanyl]amino]oxypropane?
The IUPAC name of 1-[[hydrazinylmethyl(methyl)-λ3-iodanyl]amino]oxypropane (CID 163628054) is 1-[[hydrazinylmethyl(methyl)-λ3-iodanyl]amino]oxypropane.
What is the SMILES notation for 1-[[hydrazinylmethyl(methyl)-λ3-iodanyl]amino]oxypropane?
The canonical SMILES for 1-[[hydrazinylmethyl(methyl)-λ3-iodanyl]amino]oxypropane is CCCONI(C)CNN.
What is the InChIKey of 1-[[hydrazinylmethyl(methyl)-λ3-iodanyl]amino]oxypropane?
The InChIKey is HTRMAEKBQVFPBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H16IN3O/c1-3-4-10-9-6(2)5-8-7/h8-9H,3-5,7H2,1-2H3.
What are the key properties of 1-[[hydrazinylmethyl(methyl)-λ3-iodanyl]amino]oxypropane?
1-[[hydrazinylmethyl(methyl)-λ3-iodanyl]amino]oxypropane has a molecular weight of 261.11 g/mol, XLogP of 0.39, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[hydrazinylmethyl(methyl)-λ3-iodanyl]amino]oxypropane is sourced from PubChem (CID 163628054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).