N-(cyclohex-3-en-1-ylmethylideneamino)decanamide

C17H30N2O — CID 5228148

IUPACN-(cyclohex-3-en-1-ylmethylideneamino)decanamide
SMILESCCCCCCCCCC(=O)NN=CC1CC=CCC1
InChIInChI=1S/C17H30N2O/c1-2-3-4-5-6-7-11-14-17(20)19-18-15-16-12-9-8-10-13-16/h8-9,15-16H,2-7,10-14H2,1H3,(H,19,20)
InChIKeyGFNGALGGSJHLOX-UHFFFAOYSA-N
MW278.44 g/mol
LogP4.59
Rot. Bonds10

About N-(cyclohex-3-en-1-ylmethylideneamino)decanamide

N-(cyclohex-3-en-1-ylmethylideneamino)decanamide (PubChem CID 5228148) has the molecular formula C17H30N2O and a molecular weight of 278.44 g/mol. Its IUPAC name is N-(cyclohex-3-en-1-ylmethylideneamino)decanamide.

Molecular Properties

Compound NameN-(cyclohex-3-en-1-ylmethylideneamino)decanamide
PubChem CID5228148
Molecular FormulaC17H30N2O
Molecular Weight278.44 g/mol
Exact Mass278.24
IUPAC NameN-(cyclohex-3-en-1-ylmethylideneamino)decanamide
SMILESCCCCCCCCCC(=O)NN=CC1CC=CCC1
InChIInChI=1S/C17H30N2O/c1-2-3-4-5-6-7-11-14-17(20)19-18-15-16-12-9-8-10-13-16/h8-9,15-16H,2-7,10-14H2,1H3,(H,19,20)
InChIKeyGFNGALGGSJHLOX-UHFFFAOYSA-N
XLogP4.59
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.44
LogP ≤ 54.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4a,5,8,8a-tetrahydro-2H-phthalazin-1-one
CID 17921898
N'~1~,N'~10~-bis(3-cyclohexen-1-ylmethylene)decanedihydrazide
CID 5339736
N'~1~,N'~5~-bis(3-cyclohexen-1-ylmethylene)pentanedihydrazide
CID 9615447
N'-[(E)-cyclohex-3-en-1-ylmethylidene]cyclohexanecarbohydrazide
CID 9649246
N-[(E)-[(3S)-3,7-dimethyloct-6-enylidene]amino]-N'-hydroxyheptanediamide
CID 44506967
N'-hydroxy-N-[(E)-[(4S)-4-prop-1-en-2-ylcyclohexen-1-yl]methylideneamino]hexanediamide
CID 44507345
N-[(E)-[(3R)-3,7-dimethyloct-6-enylidene]amino]-N'-hydroxyhexanediamide
CID 44507761
N-[(E)-[(3S)-3,7-dimethyloct-6-enylidene]amino]-N'-hydroxyhexanediamide
CID 44507762
N-[(E)-[(3R)-3,7-dimethyloct-6-enylidene]amino]-N'-hydroxyheptanediamide
CID 44507865
N-[(E)-[(3S)-3,7-dimethyloct-6-enylidene]amino]-N'-hydroxyoctanediamide
CID 44507898
N-[(E)-cyclohex-3-en-1-ylmethylideneamino]-N'-[(Z)-cyclohex-3-en-1-ylmethylideneamino]pentanediamide
CID 54610046
(4aR,8aS)-4a,5,8,8a-tetrahydro-2H-phthalazin-1-one
CID 67503627

Frequently Asked Questions

What is the IUPAC name of N-(cyclohex-3-en-1-ylmethylideneamino)decanamide?
The IUPAC name of N-(cyclohex-3-en-1-ylmethylideneamino)decanamide (CID 5228148) is N-(cyclohex-3-en-1-ylmethylideneamino)decanamide.
What is the SMILES notation for N-(cyclohex-3-en-1-ylmethylideneamino)decanamide?
The canonical SMILES for N-(cyclohex-3-en-1-ylmethylideneamino)decanamide is CCCCCCCCCC(=O)NN=CC1CC=CCC1.
What is the InChIKey of N-(cyclohex-3-en-1-ylmethylideneamino)decanamide?
The InChIKey is GFNGALGGSJHLOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N2O/c1-2-3-4-5-6-7-11-14-17(20)19-18-15-16-12-9-8-10-13-16/h8-9,15-16H,2-7,10-14H2,1H3,(H,19,20).
What are the key properties of N-(cyclohex-3-en-1-ylmethylideneamino)decanamide?
N-(cyclohex-3-en-1-ylmethylideneamino)decanamide has a molecular weight of 278.44 g/mol, XLogP of 4.59, 10 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohex-3-en-1-ylmethylideneamino)decanamide is sourced from PubChem (CID 5228148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).