N-(hexan-2-ylideneamino)octanamide

C14H28N2O — CID 4148475

IUPACN-(hexan-2-ylideneamino)octanamide
SMILESCCCCCCCC(=O)NN=C(C)CCCC
InChIInChI=1S/C14H28N2O/c1-4-6-8-9-10-12-14(17)16-15-13(3)11-7-5-2/h4-12H2,1-3H3,(H,16,17)
InChIKeyKRNLASHDODXVSI-UHFFFAOYSA-N
MW240.39 g/mol
LogP4.03
Rot. Bonds10

About N-(hexan-2-ylideneamino)octanamide

N-(hexan-2-ylideneamino)octanamide (PubChem CID 4148475) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is N-(hexan-2-ylideneamino)octanamide.

Molecular Properties

Compound NameN-(hexan-2-ylideneamino)octanamide
PubChem CID4148475
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC NameN-(hexan-2-ylideneamino)octanamide
SMILESCCCCCCCC(=O)NN=C(C)CCCC
InChIInChI=1S/C14H28N2O/c1-4-6-8-9-10-12-14(17)16-15-13(3)11-7-5-2/h4-12H2,1-3H3,(H,16,17)
InChIKeyKRNLASHDODXVSI-UHFFFAOYSA-N
XLogP4.03
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 54.03
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': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-(hexan-2-ylideneamino)heptanamide
CID 4616391
N-(pentan-2-ylideneamino)undecanamide
CID 3423517
N,N'-bis(undecan-2-ylideneamino)oxamide
CID 3097994
N-[(Z)-3-methylbutan-2-ylideneamino]nonanamide
CID 6005441
N-(4-methylpentan-2-ylideneamino)pentanamide
CID 5150903
N-[(4-anilino-4-oxobutan-2-ylidene)amino]dodecanamide
CID 4549541
(nonadec-10-en-2-ylideneamino)urea
CID 71326598
[(Z)-hexan-2-ylideneamino]urea
CID 6152474
N-(2,4-dimethylpentan-3-ylideneamino)undecanamide
CID 5187619
N-(3,4-dimethylphenyl)-N'-[(E)-heptan-2-ylideneamino]butanediamide
CID 54784789
N-(1-phenylpentylideneamino)octanamide
CID 4676930
6-(methylamino)-N-[(E)-5-oxohexan-2-ylideneamino]hexanamide
CID 156522659

Frequently Asked Questions

What is the IUPAC name of N-(hexan-2-ylideneamino)octanamide?
The IUPAC name of N-(hexan-2-ylideneamino)octanamide (CID 4148475) is N-(hexan-2-ylideneamino)octanamide.
What is the SMILES notation for N-(hexan-2-ylideneamino)octanamide?
The canonical SMILES for N-(hexan-2-ylideneamino)octanamide is CCCCCCCC(=O)NN=C(C)CCCC.
What is the InChIKey of N-(hexan-2-ylideneamino)octanamide?
The InChIKey is KRNLASHDODXVSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-4-6-8-9-10-12-14(17)16-15-13(3)11-7-5-2/h4-12H2,1-3H3,(H,16,17).
What are the key properties of N-(hexan-2-ylideneamino)octanamide?
N-(hexan-2-ylideneamino)octanamide has a molecular weight of 240.39 g/mol, XLogP of 4.03, 10 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(hexan-2-ylideneamino)octanamide is sourced from PubChem (CID 4148475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).