O-hept-6-enylhydroxylamine

C7H15NO — CID 107007734

IUPACO-hept-6-enylhydroxylamine
SMILESC=CCCCCCON
InChIInChI=1S/C7H15NO/c1-2-3-4-5-6-7-9-8/h2H,1,3-8H2
InChIKeyMJHGGUGYDMVDTC-UHFFFAOYSA-N
MW129.20 g/mol
LogP1.62
Rot. Bonds6

About O-hept-6-enylhydroxylamine

O-hept-6-enylhydroxylamine (PubChem CID 107007734) has the molecular formula C7H15NO and a molecular weight of 129.20 g/mol. Its IUPAC name is O-hept-6-enylhydroxylamine.

Molecular Properties

Compound NameO-hept-6-enylhydroxylamine
PubChem CID107007734
Molecular FormulaC7H15NO
Molecular Weight129.20 g/mol
Exact Mass129.12
IUPAC NameO-hept-6-enylhydroxylamine
SMILESC=CCCCCCON
InChIInChI=1S/C7H15NO/c1-2-3-4-5-6-7-9-8/h2H,1,3-8H2
InChIKeyMJHGGUGYDMVDTC-UHFFFAOYSA-N
XLogP1.62
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.20
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

O-(pent-4-en-1-yl)hydroxylamine
CID 54416047
O-(undec-10-en-1-yl)hydroxylamine
CID 59030215
Hept-6-enyl hypofluorite
CID 152246047
Hept-6-en-1-olate
CID 20653054
O-(5-Hexenyl)hydroxylamine
CID 91622084
O-dec-9-enylhydroxylamine
CID 135367829
Hept-6-en-1-yl nitrate
CID 139910357
O-(5-Hexenyl)hydroxylamine Hydrochloride
CID 156027702
O-dodec-11-enylhydroxylamine
CID 101775093
O-non-8-enylhydroxylamine
CID 143568291
O-(6-Heptenyl)hydroxylamine Hydrochloride
CID 156027726

Frequently Asked Questions

What is the IUPAC name of O-hept-6-enylhydroxylamine?
The IUPAC name of O-hept-6-enylhydroxylamine (CID 107007734) is O-hept-6-enylhydroxylamine.
What is the SMILES notation for O-hept-6-enylhydroxylamine?
The canonical SMILES for O-hept-6-enylhydroxylamine is C=CCCCCCON.
What is the InChIKey of O-hept-6-enylhydroxylamine?
The InChIKey is MJHGGUGYDMVDTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO/c1-2-3-4-5-6-7-9-8/h2H,1,3-8H2.
What are the key properties of O-hept-6-enylhydroxylamine?
O-hept-6-enylhydroxylamine has a molecular weight of 129.20 g/mol, XLogP of 1.62, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for O-hept-6-enylhydroxylamine is sourced from PubChem (CID 107007734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).