N-(1-thiophen-2-ylethylideneamino)octanamide

C14H22N2OS — CID 2841814

IUPACN-(1-thiophen-2-ylethylideneamino)octanamide
SMILESCCCCCCCC(=O)NN=C(C)c1cccs1
InChIInChI=1S/C14H22N2OS/c1-3-4-5-6-7-10-14(17)16-15-12(2)13-9-8-11-18-13/h8-9,11H,3-7,10H2,1-2H3,(H,16,17)
InChIKeyJPPYSXGYBIWKJI-UHFFFAOYSA-N
MW266.41 g/mol
LogP3.95
Rot. Bonds8

About N-(1-thiophen-2-ylethylideneamino)octanamide

N-(1-thiophen-2-ylethylideneamino)octanamide (PubChem CID 2841814) has the molecular formula C14H22N2OS and a molecular weight of 266.41 g/mol. Its IUPAC name is N-(1-thiophen-2-ylethylideneamino)octanamide.

Molecular Properties

Compound NameN-(1-thiophen-2-ylethylideneamino)octanamide
PubChem CID2841814
Molecular FormulaC14H22N2OS
Molecular Weight266.41 g/mol
Exact Mass266.15
IUPAC NameN-(1-thiophen-2-ylethylideneamino)octanamide
SMILESCCCCCCCC(=O)NN=C(C)c1cccs1
InChIInChI=1S/C14H22N2OS/c1-3-4-5-6-7-10-14(17)16-15-12(2)13-9-8-11-18-13/h8-9,11H,3-7,10H2,1-2H3,(H,16,17)
InChIKeyJPPYSXGYBIWKJI-UHFFFAOYSA-N
XLogP3.95
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.41
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(1-thiophen-2-ylethylideneamino)dodecanamide
CID 4295829
N-[(E)-1-thiophen-2-ylethylideneamino]nonanamide
CID 6307256
N,N'-bis[(E)-1-thiophen-2-ylethylideneamino]heptanediamide
CID 19685885
N-[4-[(Z)-N-(decanoylamino)-C-methylcarbonimidoyl]phenyl]thiophene-2-carboxamide
CID 6381185
N-[4-[N-(heptanoylamino)-C-methylcarbonimidoyl]phenyl]thiophene-2-carboxamide
CID 5059756
N-[(E)-1-(5-bromothiophen-2-yl)ethylideneamino]decanamide
CID 6299261
N-[1-(5-bromothiophen-2-yl)ethylideneamino]hexanamide
CID 4120530
N-[4-[C-methyl-N-(pentanoylamino)carbonimidoyl]phenyl]thiophene-2-carboxamide
CID 3258777
N',N'-diphenyl-N-(1-thiophen-2-ylethylideneamino)butanediamide
CID 3886917
2-phenyl-N-[(E)-1-thiophen-2-ylethylideneamino]acetamide
CID 6116253
3-phenylsulfanyl-N-(1-thiophen-2-ylethylideneamino)propanamide
CID 3828723
N-[(E)-1-(2-hydroxyphenyl)ethylideneamino]octanamide
CID 135458893

Frequently Asked Questions

What is the IUPAC name of N-(1-thiophen-2-ylethylideneamino)octanamide?
The IUPAC name of N-(1-thiophen-2-ylethylideneamino)octanamide (CID 2841814) is N-(1-thiophen-2-ylethylideneamino)octanamide.
What is the SMILES notation for N-(1-thiophen-2-ylethylideneamino)octanamide?
The canonical SMILES for N-(1-thiophen-2-ylethylideneamino)octanamide is CCCCCCCC(=O)NN=C(C)c1cccs1.
What is the InChIKey of N-(1-thiophen-2-ylethylideneamino)octanamide?
The InChIKey is JPPYSXGYBIWKJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2OS/c1-3-4-5-6-7-10-14(17)16-15-12(2)13-9-8-11-18-13/h8-9,11H,3-7,10H2,1-2H3,(H,16,17).
What are the key properties of N-(1-thiophen-2-ylethylideneamino)octanamide?
N-(1-thiophen-2-ylethylideneamino)octanamide has a molecular weight of 266.41 g/mol, XLogP of 3.95, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-thiophen-2-ylethylideneamino)octanamide is sourced from PubChem (CID 2841814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).