N-(3,7-dimethylocta-2,6-dienylideneamino)-2-hydroxybenzamide

C17H22N2O2 — CID 2827312

IUPACN-(3,7-dimethylocta-2,6-dienylideneamino)-2-hydroxybenzamide
SMILESCC(C)=CCCC(C)=CC=NNC(=O)c1ccccc1O
InChIInChI=1S/C17H22N2O2/c1-13(2)7-6-8-14(3)11-12-18-19-17(21)15-9-4-5-10-16(15)20/h4-5,7,9-12,20H,6,8H2,1-3H3,(H,19,21)
InChIKeyGLGUPBYNUGOLNV-UHFFFAOYSA-N
MW286.38 g/mol
LogP3.80
Rot. Bonds6

About N-(3,7-dimethylocta-2,6-dienylideneamino)-2-hydroxybenzamide

N-(3,7-dimethylocta-2,6-dienylideneamino)-2-hydroxybenzamide (PubChem CID 2827312) has the molecular formula C17H22N2O2 and a molecular weight of 286.38 g/mol. Its IUPAC name is N-(3,7-dimethylocta-2,6-dienylideneamino)-2-hydroxybenzamide.

Molecular Properties

Compound NameN-(3,7-dimethylocta-2,6-dienylideneamino)-2-hydroxybenzamide
PubChem CID2827312
Molecular FormulaC17H22N2O2
Molecular Weight286.38 g/mol
Exact Mass286.17
IUPAC NameN-(3,7-dimethylocta-2,6-dienylideneamino)-2-hydroxybenzamide
SMILESCC(C)=CCCC(C)=CC=NNC(=O)c1ccccc1O
InChIInChI=1S/C17H22N2O2/c1-13(2)7-6-8-14(3)11-12-18-19-17(21)15-9-4-5-10-16(15)20/h4-5,7,9-12,20H,6,8H2,1-3H3,(H,19,21)
InChIKeyGLGUPBYNUGOLNV-UHFFFAOYSA-N
XLogP3.80
TPSA61.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.38
LogP ≤ 53.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-(3,7-dimethylocta-2,6-dienylideneamino)-2-hydroxybenzamide 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

N-(3,7-dimethylocta-2,6-dienylideneamino)-3-hydroxynaphthalene-2-carboxamide
CID 3956222
N-(3,7-dimethylocta-2,6-dienylideneamino)-2-nitrobenzamide
CID 535330
4-chloro-N-[[(2E)-3,7-dimethylocta-2,6-dienylidene]amino]benzamide
CID 129460373
N-benzyl-N'-(3,7-dimethylocta-2,6-dienylideneamino)butanediamide
CID 3317307
N-(3,7-dimethylocta-2,6-dienylideneamino)-2-phenylcyclopropane-1-carboxamide
CID 3098185
2-hydroxy-N-(pentylideneamino)benzamide
CID 3686688
1-(2-hydroxyphenyl)-6-methylhept-5-en-1-one
CID 134961590
2-hydroxy-N-[(Z)-(2-methylphenyl)methylideneamino]benzamide
CID 5392167
(2E)-3,7-dimethylocta-2,6-dienal;1-phenylethyl 2-hydroxybenzoate
CID 122453856
N-[(Z)-[(3S)-3,7-dimethyloct-6-enylidene]amino]-2-fluorobenzamide
CID 9236025
2-bromo-N-[(Z)-[(3S)-3,7-dimethyloct-6-enylidene]amino]benzamide
CID 9016492
N-methyl-2-(3,7,11-trimethyldodeca-2,6,10-trienylsulfanyl)benzamide
CID 74403172

Frequently Asked Questions

What is the IUPAC name of N-(3,7-dimethylocta-2,6-dienylideneamino)-2-hydroxybenzamide?
The IUPAC name of N-(3,7-dimethylocta-2,6-dienylideneamino)-2-hydroxybenzamide (CID 2827312) is N-(3,7-dimethylocta-2,6-dienylideneamino)-2-hydroxybenzamide.
What is the SMILES notation for N-(3,7-dimethylocta-2,6-dienylideneamino)-2-hydroxybenzamide?
The canonical SMILES for N-(3,7-dimethylocta-2,6-dienylideneamino)-2-hydroxybenzamide is CC(C)=CCCC(C)=CC=NNC(=O)c1ccccc1O.
What is the InChIKey of N-(3,7-dimethylocta-2,6-dienylideneamino)-2-hydroxybenzamide?
The InChIKey is GLGUPBYNUGOLNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O2/c1-13(2)7-6-8-14(3)11-12-18-19-17(21)15-9-4-5-10-16(15)20/h4-5,7,9-12,20H,6,8H2,1-3H3,(H,19,21).
What are the key properties of N-(3,7-dimethylocta-2,6-dienylideneamino)-2-hydroxybenzamide?
N-(3,7-dimethylocta-2,6-dienylideneamino)-2-hydroxybenzamide has a molecular weight of 286.38 g/mol, XLogP of 3.80, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,7-dimethylocta-2,6-dienylideneamino)-2-hydroxybenzamide is sourced from PubChem (CID 2827312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).