(E)-N-(3-methylbutyl)dec-2-enamide

C15H29NO — CID 86694801

IUPAC(E)-N-(3-methylbutyl)dec-2-enamide
SMILESCCCCCCC/C=C/C(=O)NCCC(C)C
InChIInChI=1S/C15H29NO/c1-4-5-6-7-8-9-10-11-15(17)16-13-12-14(2)3/h10-11,14H,4-9,12-13H2,1-3H3,(H,16,17)/b11-10+
InChIKeyHZNIJLFOQNVLLN-ZHACJKMWSA-N
MW239.40 g/mol
LogP4.07
Rot. Bonds10

About (E)-N-(3-methylbutyl)dec-2-enamide

(E)-N-(3-methylbutyl)dec-2-enamide (PubChem CID 86694801) has the molecular formula C15H29NO and a molecular weight of 239.40 g/mol. Its IUPAC name is (E)-N-(3-methylbutyl)dec-2-enamide.

Molecular Properties

Compound Name(E)-N-(3-methylbutyl)dec-2-enamide
PubChem CID86694801
Molecular FormulaC15H29NO
Molecular Weight239.40 g/mol
Exact Mass239.22
IUPAC Name(E)-N-(3-methylbutyl)dec-2-enamide
SMILESCCCCCCC/C=C/C(=O)NCCC(C)C
InChIInChI=1S/C15H29NO/c1-4-5-6-7-8-9-10-11-15(17)16-13-12-14(2)3/h10-11,14H,4-9,12-13H2,1-3H3,(H,16,17)/b11-10+
InChIKeyHZNIJLFOQNVLLN-ZHACJKMWSA-N
XLogP4.07
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.40
LogP ≤ 54.07
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'}

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Related Compounds

Pellitorine
CID 5318516
Spilanthol
CID 5353001
N-Isobutyl-2,4,8,10,12-tetradecapentaenamide
CID 5318518
Dodecatetraenoic acid isobutylamide, (2E,4E)-
CID 6443006
Pipericine
CID 9974234
(E,E)-2,4-Decadienoic isobutylamide
CID 11368078
Dodeca-2E,4E,8Z,10Z-Tetraenoic Acid Isobutylamide
CID 11413953
Tetradeca-2E,4E-Dienoic Acid Isobutylamide
CID 10731388
N-isobutyl-2E,4Z-octadecadienoyl amine
CID 101713141
2,4,14-Eicosatrienoic acid isobutylamide
CID 10338645
(2E,4E,8Z)-N-isobutyltetradeca-2,4,8-trienamide
CID 73355665
(2E,4E,8Z,10E)-N-(2-methylpropyl)dodeca-2,4,8,10-tetraenamide
CID 6440539

Frequently Asked Questions

What is the IUPAC name of (E)-N-(3-methylbutyl)dec-2-enamide?
The IUPAC name of (E)-N-(3-methylbutyl)dec-2-enamide (CID 86694801) is (E)-N-(3-methylbutyl)dec-2-enamide.
What is the SMILES notation for (E)-N-(3-methylbutyl)dec-2-enamide?
The canonical SMILES for (E)-N-(3-methylbutyl)dec-2-enamide is CCCCCCC/C=C/C(=O)NCCC(C)C.
What is the InChIKey of (E)-N-(3-methylbutyl)dec-2-enamide?
The InChIKey is HZNIJLFOQNVLLN-ZHACJKMWSA-N. The full InChI is InChI=1S/C15H29NO/c1-4-5-6-7-8-9-10-11-15(17)16-13-12-14(2)3/h10-11,14H,4-9,12-13H2,1-3H3,(H,16,17)/b11-10+.
What are the key properties of (E)-N-(3-methylbutyl)dec-2-enamide?
(E)-N-(3-methylbutyl)dec-2-enamide has a molecular weight of 239.40 g/mol, XLogP of 4.07, 10 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-(3-methylbutyl)dec-2-enamide is sourced from PubChem (CID 86694801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).