N-hydroxy-5-methylidenehept-6-enamide

C8H13NO2 — CID 11252135

IUPACN-hydroxy-5-methylidenehept-6-enamide
SMILESC=CC(=C)CCCC(=O)NO
InChIInChI=1S/C8H13NO2/c1-3-7(2)5-4-6-8(10)9-11/h3,11H,1-2,4-6H2,(H,9,10)
InChIKeyJOJOQUYIVCQXQS-UHFFFAOYSA-N
MW155.20 g/mol
LogP1.40
Rot. Bonds5

About N-hydroxy-5-methylidenehept-6-enamide

N-hydroxy-5-methylidenehept-6-enamide (PubChem CID 11252135) has the molecular formula C8H13NO2 and a molecular weight of 155.20 g/mol. Its IUPAC name is N-hydroxy-5-methylidenehept-6-enamide.

Molecular Properties

Compound NameN-hydroxy-5-methylidenehept-6-enamide
PubChem CID11252135
Molecular FormulaC8H13NO2
Molecular Weight155.20 g/mol
Exact Mass155.09
IUPAC NameN-hydroxy-5-methylidenehept-6-enamide
SMILESC=CC(=C)CCCC(=O)NO
InChIInChI=1S/C8H13NO2/c1-3-7(2)5-4-6-8(10)9-11/h3,11H,1-2,4-6H2,(H,9,10)
InChIKeyJOJOQUYIVCQXQS-UHFFFAOYSA-N
XLogP1.40
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.20
LogP ≤ 51.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-hydroxy-5-methylidenehept-6-enamide?
The IUPAC name of N-hydroxy-5-methylidenehept-6-enamide (CID 11252135) is N-hydroxy-5-methylidenehept-6-enamide.
What is the SMILES notation for N-hydroxy-5-methylidenehept-6-enamide?
The canonical SMILES for N-hydroxy-5-methylidenehept-6-enamide is C=CC(=C)CCCC(=O)NO.
What is the InChIKey of N-hydroxy-5-methylidenehept-6-enamide?
The InChIKey is JOJOQUYIVCQXQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NO2/c1-3-7(2)5-4-6-8(10)9-11/h3,11H,1-2,4-6H2,(H,9,10).
What are the key properties of N-hydroxy-5-methylidenehept-6-enamide?
N-hydroxy-5-methylidenehept-6-enamide has a molecular weight of 155.20 g/mol, XLogP of 1.40, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-5-methylidenehept-6-enamide is sourced from PubChem (CID 11252135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).