(6Z)-3,7-dimethyl-N-(4-oxopentyl)nona-6,8-dienamide

C16H27NO2 — CID 155260155

IUPAC(6Z)-3,7-dimethyl-N-(4-oxopentyl)nona-6,8-dienamide
SMILESC=C/C(C)=C\CCC(C)CC(=O)NCCCC(C)=O
InChIInChI=1S/C16H27NO2/c1-5-13(2)8-6-9-14(3)12-16(19)17-11-7-10-15(4)18/h5,8,14H,1,6-7,9-12H2,2-4H3,(H,17,19)/b13-8-
InChIKeyKFUDWXUJVSFLLJ-JYRVWZFOSA-N
MW265.40 g/mol
LogP3.41
Rot. Bonds10

About (6Z)-3,7-dimethyl-N-(4-oxopentyl)nona-6,8-dienamide

(6Z)-3,7-dimethyl-N-(4-oxopentyl)nona-6,8-dienamide (PubChem CID 155260155) has the molecular formula C16H27NO2 and a molecular weight of 265.40 g/mol. Its IUPAC name is (6Z)-3,7-dimethyl-N-(4-oxopentyl)nona-6,8-dienamide.

Molecular Properties

Compound Name(6Z)-3,7-dimethyl-N-(4-oxopentyl)nona-6,8-dienamide
PubChem CID155260155
Molecular FormulaC16H27NO2
Molecular Weight265.40 g/mol
Exact Mass265.20
IUPAC Name(6Z)-3,7-dimethyl-N-(4-oxopentyl)nona-6,8-dienamide
SMILESC=C/C(C)=C\CCC(C)CC(=O)NCCCC(C)=O
InChIInChI=1S/C16H27NO2/c1-5-13(2)8-6-9-14(3)12-16(19)17-11-7-10-15(4)18/h5,8,14H,1,6-7,9-12H2,2-4H3,(H,17,19)/b13-8-
InChIKeyKFUDWXUJVSFLLJ-JYRVWZFOSA-N
XLogP3.41
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze (6Z)-3,7-dimethyl-N-(4-oxopentyl)nona-6,8-dienamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (6Z)-3,7-dimethyl-N-(4-oxopentyl)nona-6,8-dienamide?
The IUPAC name of (6Z)-3,7-dimethyl-N-(4-oxopentyl)nona-6,8-dienamide (CID 155260155) is (6Z)-3,7-dimethyl-N-(4-oxopentyl)nona-6,8-dienamide.
What is the SMILES notation for (6Z)-3,7-dimethyl-N-(4-oxopentyl)nona-6,8-dienamide?
The canonical SMILES for (6Z)-3,7-dimethyl-N-(4-oxopentyl)nona-6,8-dienamide is C=C/C(C)=C\CCC(C)CC(=O)NCCCC(C)=O.
What is the InChIKey of (6Z)-3,7-dimethyl-N-(4-oxopentyl)nona-6,8-dienamide?
The InChIKey is KFUDWXUJVSFLLJ-JYRVWZFOSA-N. The full InChI is InChI=1S/C16H27NO2/c1-5-13(2)8-6-9-14(3)12-16(19)17-11-7-10-15(4)18/h5,8,14H,1,6-7,9-12H2,2-4H3,(H,17,19)/b13-8-.
What are the key properties of (6Z)-3,7-dimethyl-N-(4-oxopentyl)nona-6,8-dienamide?
(6Z)-3,7-dimethyl-N-(4-oxopentyl)nona-6,8-dienamide has a molecular weight of 265.40 g/mol, XLogP of 3.41, 10 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6Z)-3,7-dimethyl-N-(4-oxopentyl)nona-6,8-dienamide is sourced from PubChem (CID 155260155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).