O-[(Z)-4-methyl-3-methylidenepent-1-enyl]hydroxylamine

C7H13NO — CID 147805987

IUPACO-[(Z)-4-methyl-3-methylidenepent-1-enyl]hydroxylamine
SMILESC=C(/C=C\ON)C(C)C
InChIInChI=1S/C7H13NO/c1-6(2)7(3)4-5-9-8/h4-6H,3,8H2,1-2H3/b5-4-
InChIKeyHMLCZJAAFMNRCN-PLNGDYQASA-N
MW127.19 g/mol
LogP1.60
Rot. Bonds3

About O-[(Z)-4-methyl-3-methylidenepent-1-enyl]hydroxylamine

O-[(Z)-4-methyl-3-methylidenepent-1-enyl]hydroxylamine (PubChem CID 147805987) has the molecular formula C7H13NO and a molecular weight of 127.19 g/mol. Its IUPAC name is O-[(Z)-4-methyl-3-methylidenepent-1-enyl]hydroxylamine.

Molecular Properties

Compound NameO-[(Z)-4-methyl-3-methylidenepent-1-enyl]hydroxylamine
PubChem CID147805987
Molecular FormulaC7H13NO
Molecular Weight127.19 g/mol
Exact Mass127.10
IUPAC NameO-[(Z)-4-methyl-3-methylidenepent-1-enyl]hydroxylamine
SMILESC=C(/C=C\ON)C(C)C
InChIInChI=1S/C7H13NO/c1-6(2)7(3)4-5-9-8/h4-6H,3,8H2,1-2H3/b5-4-
InChIKeyHMLCZJAAFMNRCN-PLNGDYQASA-N
XLogP1.60
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.19
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Related Compounds

ethane;(3Z)-6-methyl-5-methylidenehepta-1,3-diene;yttrium
CID 177140629
(2Z,4Z)-7-methyl-6-methylideneocta-2,4-dien-2-amine
CID 90277185
(3E,5Z)-8-methyl-7-methylidenenona-1,3,5-trien-4-amine
CID 144536498
1-methyl-1-[(Z)-5-methyl-4-methylidenehex-2-enyl]hydrazine
CID 155262112
(Z)-7-methyl-3,6-dimethylideneoct-4-en-1-yne
CID 145388588
(2E,5Z)-8-methyl-4,7-dimethylidenenona-2,5-diene;hydroiodide
CID 143788216
(3Z,7Z)-2,10-dimethyl-5,6,9-trimethylideneundeca-1,3,7-triene;ethane
CID 143250698
3-ethenyl-6-methyl-5-methylidenehepta-1,3-diene
CID 143522614
ethane;(3Z)-hexa-1,3,5-triene;4-methyl-3-methylidenepent-1-ene
CID 145476448
(Z)-2,7-dimethyl-3,6-dimethylidenedec-4-ene;propane
CID 166116853
[(3Z,7Z)-10-methyl-5,6,9-trimethylideneundeca-1,3,7-trien-2-yl] cyanate
CID 166529302
(3Z)-6-methyl-5-methylidenehepta-1,3-dien-2-ol;2-methyloxirane
CID 143202133

Frequently Asked Questions

What is the IUPAC name of O-[(Z)-4-methyl-3-methylidenepent-1-enyl]hydroxylamine?
The IUPAC name of O-[(Z)-4-methyl-3-methylidenepent-1-enyl]hydroxylamine (CID 147805987) is O-[(Z)-4-methyl-3-methylidenepent-1-enyl]hydroxylamine.
What is the SMILES notation for O-[(Z)-4-methyl-3-methylidenepent-1-enyl]hydroxylamine?
The canonical SMILES for O-[(Z)-4-methyl-3-methylidenepent-1-enyl]hydroxylamine is C=C(/C=C\ON)C(C)C.
What is the InChIKey of O-[(Z)-4-methyl-3-methylidenepent-1-enyl]hydroxylamine?
The InChIKey is HMLCZJAAFMNRCN-PLNGDYQASA-N. The full InChI is InChI=1S/C7H13NO/c1-6(2)7(3)4-5-9-8/h4-6H,3,8H2,1-2H3/b5-4-.
What are the key properties of O-[(Z)-4-methyl-3-methylidenepent-1-enyl]hydroxylamine?
O-[(Z)-4-methyl-3-methylidenepent-1-enyl]hydroxylamine has a molecular weight of 127.19 g/mol, XLogP of 1.60, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for O-[(Z)-4-methyl-3-methylidenepent-1-enyl]hydroxylamine is sourced from PubChem (CID 147805987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).