O-(2-methylnon-4-yn-3-yloxy)hydroxylamine

C10H19NO2 — CID 102151294

IUPACO-(2-methylnon-4-yn-3-yloxy)hydroxylamine
SMILESCCCCC#CC(OON)C(C)C
InChIInChI=1S/C10H19NO2/c1-4-5-6-7-8-10(9(2)3)12-13-11/h9-10H,4-6,11H2,1-3H3
InChIKeyBFQZFNWLOJYBTN-UHFFFAOYSA-N
MW185.27 g/mol
LogP2.03
Rot. Bonds5

About O-(2-methylnon-4-yn-3-yloxy)hydroxylamine

O-(2-methylnon-4-yn-3-yloxy)hydroxylamine (PubChem CID 102151294) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is O-(2-methylnon-4-yn-3-yloxy)hydroxylamine.

Molecular Properties

Compound NameO-(2-methylnon-4-yn-3-yloxy)hydroxylamine
PubChem CID102151294
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC NameO-(2-methylnon-4-yn-3-yloxy)hydroxylamine
SMILESCCCCC#CC(OON)C(C)C
InChIInChI=1S/C10H19NO2/c1-4-5-6-7-8-10(9(2)3)12-13-11/h9-10H,4-6,11H2,1-3H3
InChIKeyBFQZFNWLOJYBTN-UHFFFAOYSA-N
XLogP2.03
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

CID 90985110
CID 90985110
O-(1-phenyloct-3-yn-2-yloxy)hydroxylamine
CID 102151297
non-3-yn-2-amine
CID 85230211
trimethyl-[(2R)-oct-3-yn-2-yl]stannane
CID 15532108
3-ethyldec-5-yn-4-ol
CID 100982942
dodec-3-yn-2-amine
CID 135042011
3-tert-butyl-2-hydroperoxy-2-methylnon-4-yne
CID 140562441
2-methyldeca-3,5-diyne
CID 10510996
pentadeca-5,10-diyne
CID 15530767
2-methylnon-4-yn-3-yl 2-(phenylmethoxycarbonylamino)acetate
CID 102505804
(3R)-2-methylundeca-4,6-diyn-3-ol
CID 53475577
hex-1-yn-1-amine
CID 15451863

Frequently Asked Questions

What is the IUPAC name of O-(2-methylnon-4-yn-3-yloxy)hydroxylamine?
The IUPAC name of O-(2-methylnon-4-yn-3-yloxy)hydroxylamine (CID 102151294) is O-(2-methylnon-4-yn-3-yloxy)hydroxylamine.
What is the SMILES notation for O-(2-methylnon-4-yn-3-yloxy)hydroxylamine?
The canonical SMILES for O-(2-methylnon-4-yn-3-yloxy)hydroxylamine is CCCCC#CC(OON)C(C)C.
What is the InChIKey of O-(2-methylnon-4-yn-3-yloxy)hydroxylamine?
The InChIKey is BFQZFNWLOJYBTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c1-4-5-6-7-8-10(9(2)3)12-13-11/h9-10H,4-6,11H2,1-3H3.
What are the key properties of O-(2-methylnon-4-yn-3-yloxy)hydroxylamine?
O-(2-methylnon-4-yn-3-yloxy)hydroxylamine has a molecular weight of 185.27 g/mol, XLogP of 2.03, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for O-(2-methylnon-4-yn-3-yloxy)hydroxylamine is sourced from PubChem (CID 102151294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).