(4R,5E)-N-hydroxy-4-methylocta-5,7-dienamide

C9H15NO2 — CID 15930225

IUPAC(4R,5E)-N-hydroxy-4-methylocta-5,7-dienamide
SMILESC=C/C=C/[C@H](C)CCC(=O)NO
InChIInChI=1S/C9H15NO2/c1-3-4-5-8(2)6-7-9(11)10-12/h3-5,8,12H,1,6-7H2,2H3,(H,10,11)/b5-4+/t8-/m0/s1
InChIKeyRESMVSZMADXSRA-ZJELKQJVSA-N
MW169.22 g/mol
LogP1.65
Rot. Bonds5

About (4R,5E)-N-hydroxy-4-methylocta-5,7-dienamide

(4R,5E)-N-hydroxy-4-methylocta-5,7-dienamide (PubChem CID 15930225) has the molecular formula C9H15NO2 and a molecular weight of 169.22 g/mol. Its IUPAC name is (4R,5E)-N-hydroxy-4-methylocta-5,7-dienamide.

Molecular Properties

Compound Name(4R,5E)-N-hydroxy-4-methylocta-5,7-dienamide
PubChem CID15930225
Molecular FormulaC9H15NO2
Molecular Weight169.22 g/mol
Exact Mass169.11
IUPAC Name(4R,5E)-N-hydroxy-4-methylocta-5,7-dienamide
SMILESC=C/C=C/[C@H](C)CCC(=O)NO
InChIInChI=1S/C9H15NO2/c1-3-4-5-8(2)6-7-9(11)10-12/h3-5,8,12H,1,6-7H2,2H3,(H,10,11)/b5-4+/t8-/m0/s1
InChIKeyRESMVSZMADXSRA-ZJELKQJVSA-N
XLogP1.65
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.22
LogP ≤ 51.65
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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Related Compounds

(5E)-N-hydroxyocta-5,7-dienamide
CID 14394704
Hept-5-ene-2-carboxamide
CID 21660794
N-hydroxy-3,7-dimethyloct-6-enamide
CID 119088732
(5Z,8Z,11Z,14Z,17Z)-N-hydroxyicosa-5,8,11,14,17-pentaenamide
CID 13579829
2-cyclopent-2-en-1-yl-N-methoxyacetamide
CID 101497214
5-Nonenohydroxamic acid
CID 129774624
(5E,7E)-N-hydroxy-5,7-dodecadienamide
CID 14394731
N-hydroxycyclohex-2-ene-1-carboxamide
CID 53424524
N-hydroxycyclohex-3-ene-1-carboxamide
CID 53712688
2-Methylhept-5-enamide
CID 54187256
2-Propylpent-3-enamide
CID 57236442
N-deuterio-N-hydroxy-2-(2-methylbenzene-6-id-1-yl)acetamide;tungsten
CID 58805984

Frequently Asked Questions

What is the IUPAC name of (4R,5E)-N-hydroxy-4-methylocta-5,7-dienamide?
The IUPAC name of (4R,5E)-N-hydroxy-4-methylocta-5,7-dienamide (CID 15930225) is (4R,5E)-N-hydroxy-4-methylocta-5,7-dienamide.
What is the SMILES notation for (4R,5E)-N-hydroxy-4-methylocta-5,7-dienamide?
The canonical SMILES for (4R,5E)-N-hydroxy-4-methylocta-5,7-dienamide is C=C/C=C/[C@H](C)CCC(=O)NO.
What is the InChIKey of (4R,5E)-N-hydroxy-4-methylocta-5,7-dienamide?
The InChIKey is RESMVSZMADXSRA-ZJELKQJVSA-N. The full InChI is InChI=1S/C9H15NO2/c1-3-4-5-8(2)6-7-9(11)10-12/h3-5,8,12H,1,6-7H2,2H3,(H,10,11)/b5-4+/t8-/m0/s1.
What are the key properties of (4R,5E)-N-hydroxy-4-methylocta-5,7-dienamide?
(4R,5E)-N-hydroxy-4-methylocta-5,7-dienamide has a molecular weight of 169.22 g/mol, XLogP of 1.65, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R,5E)-N-hydroxy-4-methylocta-5,7-dienamide is sourced from PubChem (CID 15930225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).