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

C14H25NO2 — CID 88665228

IUPAC(2E,4E)-10-hydroxy-N-(2-methylpropyl)deca-2,4-dienamide
SMILESCC(C)CNC(=O)/C=C/C=C/CCCCCO
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)/b6-4+,10-8+
InChIKeyRCEGFVARTZUWIS-ONNLMXTPSA-N
MW239.36 g/mol
LogP2.42
Rot. Bonds9

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

(2E,4E)-10-hydroxy-N-(2-methylpropyl)deca-2,4-dienamide (PubChem CID 88665228) has the molecular formula C14H25NO2 and a molecular weight of 239.36 g/mol. Its IUPAC name is (2E,4E)-10-hydroxy-N-(2-methylpropyl)deca-2,4-dienamide.

Molecular Properties

Compound Name(2E,4E)-10-hydroxy-N-(2-methylpropyl)deca-2,4-dienamide
PubChem CID88665228
Molecular FormulaC14H25NO2
Molecular Weight239.36 g/mol
Exact Mass239.19
IUPAC Name(2E,4E)-10-hydroxy-N-(2-methylpropyl)deca-2,4-dienamide
SMILESCC(C)CNC(=O)/C=C/C=C/CCCCCO
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)/b6-4+,10-8+
InChIKeyRCEGFVARTZUWIS-ONNLMXTPSA-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'}

Analyze (2E,4E)-10-hydroxy-N-(2-methylpropyl)deca-2,4-dienamide with MolForge

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Related Compounds

(2E,4E)-8-hydroxy-N-(2-methylpropyl)octa-2,4-dienamide
CID 134860994
N-(2-methylpropyl)trideca-2,4,12-trienamide
CID 87901236
(2E,4E)-N-(2-methylpropyl)tetradeca-2,4-dienamide
CID 10731388
(2E,4E,10E)-N-(2-methylpropyl)hexadeca-2,4,10-trienamide
CID 91697623
(2E)-N-(2-methylpropyl)tetradeca-2,4,6,8,10-pentaenamide
CID 149163052
(2E,4E,6Z,8Z)-N-(2-methylpropyl)dodeca-2,4,6,8-tetraenamide
CID 175711571
N-(2-methylbutyl)dodeca-2,4-dienamide
CID 162868762
(Z)-N-(2-methylpropyl)dec-2-enamide
CID 140519128
(2E,4E,8E)-N-(2-methylpropyl)undeca-2,4,8,10-tetraenamide
CID 132536757
N-(2-methylpropyl)-9-phenylnona-2,4-dienamide
CID 90802349
(2E,7Z,9E)-N-(2-methylpropyl)undeca-2,7,9-trienamide
CID 10776149
(2E,4E)-N-[(2R)-2-methylbutyl]deca-2,4-dienamide
CID 38347217

Frequently Asked Questions

What is the IUPAC name of (2E,4E)-10-hydroxy-N-(2-methylpropyl)deca-2,4-dienamide?
The IUPAC name of (2E,4E)-10-hydroxy-N-(2-methylpropyl)deca-2,4-dienamide (CID 88665228) is (2E,4E)-10-hydroxy-N-(2-methylpropyl)deca-2,4-dienamide.
What is the SMILES notation for (2E,4E)-10-hydroxy-N-(2-methylpropyl)deca-2,4-dienamide?
The canonical SMILES for (2E,4E)-10-hydroxy-N-(2-methylpropyl)deca-2,4-dienamide is CC(C)CNC(=O)/C=C/C=C/CCCCCO.
What is the InChIKey of (2E,4E)-10-hydroxy-N-(2-methylpropyl)deca-2,4-dienamide?
The InChIKey is RCEGFVARTZUWIS-ONNLMXTPSA-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)/b6-4+,10-8+.
What are the key properties of (2E,4E)-10-hydroxy-N-(2-methylpropyl)deca-2,4-dienamide?
(2E,4E)-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 (2E,4E)-10-hydroxy-N-(2-methylpropyl)deca-2,4-dienamide is sourced from PubChem (CID 88665228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).