6-hydroxy-N-propyldeca-2,4-dienamide

C13H23NO2 — CID 167499548

IUPAC6-hydroxy-N-propyldeca-2,4-dienamide
SMILESCCCCC(O)C=CC=CC(=O)NCCC
InChIInChI=1S/C13H23NO2/c1-3-5-8-12(15)9-6-7-10-13(16)14-11-4-2/h6-7,9-10,12,15H,3-5,8,11H2,1-2H3,(H,14,16)
InChIKeyFZUIDJKSEZYCCQ-UHFFFAOYSA-N
MW225.33 g/mol
LogP2.18
Rot. Bonds8

About 6-hydroxy-N-propyldeca-2,4-dienamide

6-hydroxy-N-propyldeca-2,4-dienamide (PubChem CID 167499548) has the molecular formula C13H23NO2 and a molecular weight of 225.33 g/mol. Its IUPAC name is 6-hydroxy-N-propyldeca-2,4-dienamide.

Molecular Properties

Compound Name6-hydroxy-N-propyldeca-2,4-dienamide
PubChem CID167499548
Molecular FormulaC13H23NO2
Molecular Weight225.33 g/mol
Exact Mass225.17
IUPAC Name6-hydroxy-N-propyldeca-2,4-dienamide
SMILESCCCCC(O)C=CC=CC(=O)NCCC
InChIInChI=1S/C13H23NO2/c1-3-5-8-12(15)9-6-7-10-13(16)14-11-4-2/h6-7,9-10,12,15H,3-5,8,11H2,1-2H3,(H,14,16)
InChIKeyFZUIDJKSEZYCCQ-UHFFFAOYSA-N
XLogP2.18
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.33
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

Analyze 6-hydroxy-N-propyldeca-2,4-dienamide with MolForge

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

Launch Full Analysis

Related Compounds

(2E,7E,9E)-6,11-dihydroxy-N-(2-hydroxy-2-methylpropyl)dodeca-2,7,9-trienamide
CID 71720071
Aureoverticillactam
CID 9868536
(5E,7E,11Z,13E,15E,17E)-20-[(E)-hex-2-enyl]-10-hydroxy-7,15-dimethyl-1-azacycloicosa-3,5,7,11,13,15,17-heptaen-2-one
CID 127029842
ZP-amide A
CID 71719469
(E,4R,5R)-4,5-dihydroxy-N-(2-methylpropyl)oct-2-enamide
CID 11447544
(E,4S)-4-hydroxy-N-(2-methylpropyl)hex-2-enamide
CID 12090207
4,5-dihydroxy-N-(2-methylpropyl)dec-2-enamide
CID 73804405
(2E,6R,7E,9E)-6-hydroxy-N-(2-hydroxy-2-methylpropyl)-11-oxododeca-2,7,9-trienamide
CID 101357058
Ishigamide
CID 146684497
(3E,5E,7E,9S,10R,11Z,13E,15E,17Z,19Z,21S)-9,10-dihydroxy-7,21-dimethyl-1-azacyclodocosa-3,5,7,11,13,15,17,19-octaen-2-one
CID 155552631
GT32-B
CID 10409139
4,5-dihydroxy-N-(2-methylpropyl)oct-2-enamide
CID 72965309

Frequently Asked Questions

What is the IUPAC name of 6-hydroxy-N-propyldeca-2,4-dienamide?
The IUPAC name of 6-hydroxy-N-propyldeca-2,4-dienamide (CID 167499548) is 6-hydroxy-N-propyldeca-2,4-dienamide.
What is the SMILES notation for 6-hydroxy-N-propyldeca-2,4-dienamide?
The canonical SMILES for 6-hydroxy-N-propyldeca-2,4-dienamide is CCCCC(O)C=CC=CC(=O)NCCC.
What is the InChIKey of 6-hydroxy-N-propyldeca-2,4-dienamide?
The InChIKey is FZUIDJKSEZYCCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO2/c1-3-5-8-12(15)9-6-7-10-13(16)14-11-4-2/h6-7,9-10,12,15H,3-5,8,11H2,1-2H3,(H,14,16).
What are the key properties of 6-hydroxy-N-propyldeca-2,4-dienamide?
6-hydroxy-N-propyldeca-2,4-dienamide has a molecular weight of 225.33 g/mol, XLogP of 2.18, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydroxy-N-propyldeca-2,4-dienamide is sourced from PubChem (CID 167499548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).