N-cyclohexyl-2-[(2E,4Z)-octa-2,4-dien-3-yl]oxyacetamide

C16H27NO2 — CID 146632697

IUPACN-cyclohexyl-2-[(2E,4Z)-octa-2,4-dien-3-yl]oxyacetamide
SMILESC/C=C(\C=C/CCC)OCC(=O)NC1CCCCC1
InChIInChI=1S/C16H27NO2/c1-3-5-7-12-15(4-2)19-13-16(18)17-14-10-8-6-9-11-14/h4,7,12,14H,3,5-6,8-11,13H2,1-2H3,(H,17,18)/b12-7-,15-4+
InChIKeyZGMUVYDEERUDKY-OUZDOPHASA-N
MW265.40 g/mol
LogP3.71
Rot. Bonds7

About N-cyclohexyl-2-[(2E,4Z)-octa-2,4-dien-3-yl]oxyacetamide

N-cyclohexyl-2-[(2E,4Z)-octa-2,4-dien-3-yl]oxyacetamide (PubChem CID 146632697) has the molecular formula C16H27NO2 and a molecular weight of 265.40 g/mol. Its IUPAC name is N-cyclohexyl-2-[(2E,4Z)-octa-2,4-dien-3-yl]oxyacetamide.

Molecular Properties

Compound NameN-cyclohexyl-2-[(2E,4Z)-octa-2,4-dien-3-yl]oxyacetamide
PubChem CID146632697
Molecular FormulaC16H27NO2
Molecular Weight265.40 g/mol
Exact Mass265.20
IUPAC NameN-cyclohexyl-2-[(2E,4Z)-octa-2,4-dien-3-yl]oxyacetamide
SMILESC/C=C(\C=C/CCC)OCC(=O)NC1CCCCC1
InChIInChI=1S/C16H27NO2/c1-3-5-7-12-15(4-2)19-13-16(18)17-14-10-8-6-9-11-14/h4,7,12,14H,3,5-6,8-11,13H2,1-2H3,(H,17,18)/b12-7-,15-4+
InChIKeyZGMUVYDEERUDKY-OUZDOPHASA-N
XLogP3.71
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-[(2E,4Z)-octa-2,4-dien-3-yl]oxyacetamide?
The IUPAC name of N-cyclohexyl-2-[(2E,4Z)-octa-2,4-dien-3-yl]oxyacetamide (CID 146632697) is N-cyclohexyl-2-[(2E,4Z)-octa-2,4-dien-3-yl]oxyacetamide.
What is the SMILES notation for N-cyclohexyl-2-[(2E,4Z)-octa-2,4-dien-3-yl]oxyacetamide?
The canonical SMILES for N-cyclohexyl-2-[(2E,4Z)-octa-2,4-dien-3-yl]oxyacetamide is C/C=C(\C=C/CCC)OCC(=O)NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-2-[(2E,4Z)-octa-2,4-dien-3-yl]oxyacetamide?
The InChIKey is ZGMUVYDEERUDKY-OUZDOPHASA-N. The full InChI is InChI=1S/C16H27NO2/c1-3-5-7-12-15(4-2)19-13-16(18)17-14-10-8-6-9-11-14/h4,7,12,14H,3,5-6,8-11,13H2,1-2H3,(H,17,18)/b12-7-,15-4+.
What are the key properties of N-cyclohexyl-2-[(2E,4Z)-octa-2,4-dien-3-yl]oxyacetamide?
N-cyclohexyl-2-[(2E,4Z)-octa-2,4-dien-3-yl]oxyacetamide has a molecular weight of 265.40 g/mol, XLogP of 3.71, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-[(2E,4Z)-octa-2,4-dien-3-yl]oxyacetamide is sourced from PubChem (CID 146632697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).