(3Z,5Z)-N-[(3Z,5Z)-hepta-3,5-dienyl]-2,5-dimethylhepta-3,5-dienamide

C16H25NO — CID 143484663

IUPAC(3Z,5Z)-N-[(3Z,5Z)-hepta-3,5-dienyl]-2,5-dimethylhepta-3,5-dienamide
SMILESC/C=C\C=C/CCNC(=O)C(C)/C=C\C(C)=C/C
InChIInChI=1S/C16H25NO/c1-5-7-8-9-10-13-17-16(18)15(4)12-11-14(3)6-2/h5-9,11-12,15H,10,13H2,1-4H3,(H,17,18)/b7-5-,9-8-,12-11-,14-6-
InChIKeyYILDKYVFFSAAIM-AZAQQWCXSA-N
MW247.38 g/mol
LogP3.78
Rot. Bonds7

About (3Z,5Z)-N-[(3Z,5Z)-hepta-3,5-dienyl]-2,5-dimethylhepta-3,5-dienamide

(3Z,5Z)-N-[(3Z,5Z)-hepta-3,5-dienyl]-2,5-dimethylhepta-3,5-dienamide (PubChem CID 143484663) has the molecular formula C16H25NO and a molecular weight of 247.38 g/mol. Its IUPAC name is (3Z,5Z)-N-[(3Z,5Z)-hepta-3,5-dienyl]-2,5-dimethylhepta-3,5-dienamide.

Molecular Properties

Compound Name(3Z,5Z)-N-[(3Z,5Z)-hepta-3,5-dienyl]-2,5-dimethylhepta-3,5-dienamide
PubChem CID143484663
Molecular FormulaC16H25NO
Molecular Weight247.38 g/mol
Exact Mass247.19
IUPAC Name(3Z,5Z)-N-[(3Z,5Z)-hepta-3,5-dienyl]-2,5-dimethylhepta-3,5-dienamide
SMILESC/C=C\C=C/CCNC(=O)C(C)/C=C\C(C)=C/C
InChIInChI=1S/C16H25NO/c1-5-7-8-9-10-13-17-16(18)15(4)12-11-14(3)6-2/h5-9,11-12,15H,10,13H2,1-4H3,(H,17,18)/b7-5-,9-8-,12-11-,14-6-
InChIKeyYILDKYVFFSAAIM-AZAQQWCXSA-N
XLogP3.78
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.38
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (3Z,5Z)-N-[(3Z,5Z)-hepta-3,5-dienyl]-2,5-dimethylhepta-3,5-dienamide?
The IUPAC name of (3Z,5Z)-N-[(3Z,5Z)-hepta-3,5-dienyl]-2,5-dimethylhepta-3,5-dienamide (CID 143484663) is (3Z,5Z)-N-[(3Z,5Z)-hepta-3,5-dienyl]-2,5-dimethylhepta-3,5-dienamide.
What is the SMILES notation for (3Z,5Z)-N-[(3Z,5Z)-hepta-3,5-dienyl]-2,5-dimethylhepta-3,5-dienamide?
The canonical SMILES for (3Z,5Z)-N-[(3Z,5Z)-hepta-3,5-dienyl]-2,5-dimethylhepta-3,5-dienamide is C/C=C\C=C/CCNC(=O)C(C)/C=C\C(C)=C/C.
What is the InChIKey of (3Z,5Z)-N-[(3Z,5Z)-hepta-3,5-dienyl]-2,5-dimethylhepta-3,5-dienamide?
The InChIKey is YILDKYVFFSAAIM-AZAQQWCXSA-N. The full InChI is InChI=1S/C16H25NO/c1-5-7-8-9-10-13-17-16(18)15(4)12-11-14(3)6-2/h5-9,11-12,15H,10,13H2,1-4H3,(H,17,18)/b7-5-,9-8-,12-11-,14-6-.
What are the key properties of (3Z,5Z)-N-[(3Z,5Z)-hepta-3,5-dienyl]-2,5-dimethylhepta-3,5-dienamide?
(3Z,5Z)-N-[(3Z,5Z)-hepta-3,5-dienyl]-2,5-dimethylhepta-3,5-dienamide has a molecular weight of 247.38 g/mol, XLogP of 3.78, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z,5Z)-N-[(3Z,5Z)-hepta-3,5-dienyl]-2,5-dimethylhepta-3,5-dienamide is sourced from PubChem (CID 143484663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).