(2E,4E,8E)-N-(2-methylpropyl)undeca-2,4,8,10-tetraenamide

C15H23NO — CID 132536757

IUPAC(2E,4E,8E)-N-(2-methylpropyl)undeca-2,4,8,10-tetraenamide
SMILESC=C/C=C/CC/C=C/C=C/C(=O)NCC(C)C
InChIInChI=1S/C15H23NO/c1-4-5-6-7-8-9-10-11-12-15(17)16-13-14(2)3/h4-6,9-12,14H,1,7-8,13H2,2-3H3,(H,16,17)/b6-5+,10-9+,12-11+
InChIKeyIUVGLAJTRVISMR-SENBKVFWSA-N
MW233.36 g/mol
LogP3.39
Rot. Bonds8

About (2E,4E,8E)-N-(2-methylpropyl)undeca-2,4,8,10-tetraenamide

(2E,4E,8E)-N-(2-methylpropyl)undeca-2,4,8,10-tetraenamide (PubChem CID 132536757) has the molecular formula C15H23NO and a molecular weight of 233.36 g/mol. Its IUPAC name is (2E,4E,8E)-N-(2-methylpropyl)undeca-2,4,8,10-tetraenamide.

Molecular Properties

Compound Name(2E,4E,8E)-N-(2-methylpropyl)undeca-2,4,8,10-tetraenamide
PubChem CID132536757
Molecular FormulaC15H23NO
Molecular Weight233.36 g/mol
Exact Mass233.18
IUPAC Name(2E,4E,8E)-N-(2-methylpropyl)undeca-2,4,8,10-tetraenamide
SMILESC=C/C=C/CC/C=C/C=C/C(=O)NCC(C)C
InChIInChI=1S/C15H23NO/c1-4-5-6-7-8-9-10-11-12-15(17)16-13-14(2)3/h4-6,9-12,14H,1,7-8,13H2,2-3H3,(H,16,17)/b6-5+,10-9+,12-11+
InChIKeyIUVGLAJTRVISMR-SENBKVFWSA-N
XLogP3.39
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.36
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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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Related Compounds

N-(2-methylpropyl)trideca-2,4,12-trienamide
CID 87901236
(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
(2E,4E)-8-hydroxy-N-(2-methylpropyl)octa-2,4-dienamide
CID 134860994
(2E,4E)-N-(2-methylpropyl)-6-oxohepta-2,4-dienamide
CID 25195169
(2E,4E)-10-hydroxy-N-(2-methylpropyl)deca-2,4-dienamide
CID 88665228
(2E,4E)-N-(2-methylpropyl)tetradeca-2,4-dienamide
CID 10731388
(2E,4E,10E)-N-(2-methylpropyl)hexadeca-2,4,10-trienamide
CID 91697623
11-hydroxy-N-(2-methylpropyl)tetradeca-2,4,8-trienamide
CID 163037919
N-(2-methylpropyl)dodeca-2,4-dien-8,10-diynamide
CID 71337744
(2E,7Z,9E)-N-(2-methylpropyl)undeca-2,7,9-trienamide
CID 10776149
(2E,4Z)-6-hydroxy-7-methyl-N-(2-methylpropyl)octa-2,4-dienamide
CID 15416267

Frequently Asked Questions

What is the IUPAC name of (2E,4E,8E)-N-(2-methylpropyl)undeca-2,4,8,10-tetraenamide?
The IUPAC name of (2E,4E,8E)-N-(2-methylpropyl)undeca-2,4,8,10-tetraenamide (CID 132536757) is (2E,4E,8E)-N-(2-methylpropyl)undeca-2,4,8,10-tetraenamide.
What is the SMILES notation for (2E,4E,8E)-N-(2-methylpropyl)undeca-2,4,8,10-tetraenamide?
The canonical SMILES for (2E,4E,8E)-N-(2-methylpropyl)undeca-2,4,8,10-tetraenamide is C=C/C=C/CC/C=C/C=C/C(=O)NCC(C)C.
What is the InChIKey of (2E,4E,8E)-N-(2-methylpropyl)undeca-2,4,8,10-tetraenamide?
The InChIKey is IUVGLAJTRVISMR-SENBKVFWSA-N. The full InChI is InChI=1S/C15H23NO/c1-4-5-6-7-8-9-10-11-12-15(17)16-13-14(2)3/h4-6,9-12,14H,1,7-8,13H2,2-3H3,(H,16,17)/b6-5+,10-9+,12-11+.
What are the key properties of (2E,4E,8E)-N-(2-methylpropyl)undeca-2,4,8,10-tetraenamide?
(2E,4E,8E)-N-(2-methylpropyl)undeca-2,4,8,10-tetraenamide has a molecular weight of 233.36 g/mol, XLogP of 3.39, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2E,4E,8E)-N-(2-methylpropyl)undeca-2,4,8,10-tetraenamide is sourced from PubChem (CID 132536757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).