10-hydroxy-N-(2-methylpropyl)deca-2,4-dienamide

C14H25NO2 — CID 86133351

IUPAC10-hydroxy-N-(2-methylpropyl)deca-2,4-dienamide
SMILESCC(C)CNC(=O)C=CC=CCCCCCO
InChIInChI=1S/C14H25NO2/c1-13(2)12-15-14(17)10-8-6-4-3-5-7-9-11-16/h4,6,8,10,13,16H,3,5,7,9,11-12H2,1-2H3,(H,15,17)
InChIKeyRCEGFVARTZUWIS-UHFFFAOYSA-N
MW239.36 g/mol
LogP2.42
Rot. Bonds9

About 10-hydroxy-N-(2-methylpropyl)deca-2,4-dienamide

10-hydroxy-N-(2-methylpropyl)deca-2,4-dienamide (PubChem CID 86133351) has the molecular formula C14H25NO2 and a molecular weight of 239.36 g/mol. Its IUPAC name is 10-hydroxy-N-(2-methylpropyl)deca-2,4-dienamide.

Molecular Properties

Compound Name10-hydroxy-N-(2-methylpropyl)deca-2,4-dienamide
PubChem CID86133351
Molecular FormulaC14H25NO2
Molecular Weight239.36 g/mol
Exact Mass239.19
IUPAC Name10-hydroxy-N-(2-methylpropyl)deca-2,4-dienamide
SMILESCC(C)CNC(=O)C=CC=CCCCCCO
InChIInChI=1S/C14H25NO2/c1-13(2)12-15-14(17)10-8-6-4-3-5-7-9-11-16/h4,6,8,10,13,16H,3,5,7,9,11-12H2,1-2H3,(H,15,17)
InChIKeyRCEGFVARTZUWIS-UHFFFAOYSA-N
XLogP2.42
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 52.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 10-hydroxy-N-(2-methylpropyl)deca-2,4-dienamide?
The IUPAC name of 10-hydroxy-N-(2-methylpropyl)deca-2,4-dienamide (CID 86133351) is 10-hydroxy-N-(2-methylpropyl)deca-2,4-dienamide.
What is the SMILES notation for 10-hydroxy-N-(2-methylpropyl)deca-2,4-dienamide?
The canonical SMILES for 10-hydroxy-N-(2-methylpropyl)deca-2,4-dienamide is CC(C)CNC(=O)C=CC=CCCCCCO.
What is the InChIKey of 10-hydroxy-N-(2-methylpropyl)deca-2,4-dienamide?
The InChIKey is RCEGFVARTZUWIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO2/c1-13(2)12-15-14(17)10-8-6-4-3-5-7-9-11-16/h4,6,8,10,13,16H,3,5,7,9,11-12H2,1-2H3,(H,15,17).
What are the key properties of 10-hydroxy-N-(2-methylpropyl)deca-2,4-dienamide?
10-hydroxy-N-(2-methylpropyl)deca-2,4-dienamide has a molecular weight of 239.36 g/mol, XLogP of 2.42, 9 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-hydroxy-N-(2-methylpropyl)deca-2,4-dienamide is sourced from PubChem (CID 86133351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).