(2E,4E)-N-piperidin-1-yldodeca-2,4-dienamide

C17H30N2O — CID 87564300

IUPAC(2E,4E)-N-piperidin-1-yldodeca-2,4-dienamide
SMILESCCCCCCC/C=C/C=C/C(=O)NN1CCCCC1
InChIInChI=1S/C17H30N2O/c1-2-3-4-5-6-7-8-9-11-14-17(20)18-19-15-12-10-13-16-19/h8-9,11,14H,2-7,10,12-13,15-16H2,1H3,(H,18,20)/b9-8+,14-11+
InChIKeyLHXDZKKWYJPDJO-HUKVCQRGSA-N
MW278.44 g/mol
LogP3.98
Rot. Bonds9

About (2E,4E)-N-piperidin-1-yldodeca-2,4-dienamide

(2E,4E)-N-piperidin-1-yldodeca-2,4-dienamide (PubChem CID 87564300) has the molecular formula C17H30N2O and a molecular weight of 278.44 g/mol. Its IUPAC name is (2E,4E)-N-piperidin-1-yldodeca-2,4-dienamide.

Molecular Properties

Compound Name(2E,4E)-N-piperidin-1-yldodeca-2,4-dienamide
PubChem CID87564300
Molecular FormulaC17H30N2O
Molecular Weight278.44 g/mol
Exact Mass278.24
IUPAC Name(2E,4E)-N-piperidin-1-yldodeca-2,4-dienamide
SMILESCCCCCCC/C=C/C=C/C(=O)NN1CCCCC1
InChIInChI=1S/C17H30N2O/c1-2-3-4-5-6-7-8-9-11-14-17(20)18-19-15-12-10-13-16-19/h8-9,11,14H,2-7,10,12-13,15-16H2,1H3,(H,18,20)/b9-8+,14-11+
InChIKeyLHXDZKKWYJPDJO-HUKVCQRGSA-N
XLogP3.98
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.44
LogP ≤ 53.98
H-Bond Donors ≤ 51
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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Related Compounds

N-pyrrolidin-1-yloctadeca-2,4-dienamide
CID 90936631
(2E,4E)-N-piperidin-1-yldeca-2,4-dienamide
CID 23071668
4-[Dimethyl(propyl)azaniumyl]butyl-dimethyl-(undec-2-enoylamino)azanium
CID 57261673
(E)-N-piperidin-1-yldec-3-enamide
CID 71766865
N-piperidin-1-yldeca-2,4-dienamide
CID 74015237
(2E,4E)-N-pyrrolidin-1-yldeca-2,4-dienamide
CID 87362083
(2E,4E)-N-pyrrolidin-1-yldodeca-2,4-dienamide
CID 87562991
12-Piperidin-1-yldodeca-2,4-dienamide
CID 87564302
Dimethyl-propyl-(undec-2-enoylamino)azanium
CID 87602259
(2E,4Z,6Z,8E,10Z,12Z)-N-(4-methylpiperazin-1-yl)docosa-2,4,6,8,10,12-hexaenamide
CID 88013000
4-[Dimethyl(propyl)azaniumyl]butyl-dimethyl-(undec-2-enoylamino)azanium dibromide
CID 88756329
N-pyrrolidin-1-yldodeca-2,4-dienamide
CID 90730106

Frequently Asked Questions

What is the IUPAC name of (2E,4E)-N-piperidin-1-yldodeca-2,4-dienamide?
The IUPAC name of (2E,4E)-N-piperidin-1-yldodeca-2,4-dienamide (CID 87564300) is (2E,4E)-N-piperidin-1-yldodeca-2,4-dienamide.
What is the SMILES notation for (2E,4E)-N-piperidin-1-yldodeca-2,4-dienamide?
The canonical SMILES for (2E,4E)-N-piperidin-1-yldodeca-2,4-dienamide is CCCCCCC/C=C/C=C/C(=O)NN1CCCCC1.
What is the InChIKey of (2E,4E)-N-piperidin-1-yldodeca-2,4-dienamide?
The InChIKey is LHXDZKKWYJPDJO-HUKVCQRGSA-N. The full InChI is InChI=1S/C17H30N2O/c1-2-3-4-5-6-7-8-9-11-14-17(20)18-19-15-12-10-13-16-19/h8-9,11,14H,2-7,10,12-13,15-16H2,1H3,(H,18,20)/b9-8+,14-11+.
What are the key properties of (2E,4E)-N-piperidin-1-yldodeca-2,4-dienamide?
(2E,4E)-N-piperidin-1-yldodeca-2,4-dienamide has a molecular weight of 278.44 g/mol, XLogP of 3.98, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2E,4E)-N-piperidin-1-yldodeca-2,4-dienamide is sourced from PubChem (CID 87564300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).