N-[(Z)-3,4-dihydro-2H-naphthalen-1-ylideneamino]octanamide

C18H26N2O — CID 6297520

IUPACN-[(Z)-3,4-dihydro-2H-naphthalen-1-ylideneamino]octanamide
SMILESCCCCCCCC(=O)N/N=C1/CCCc2ccccc21
InChIInChI=1S/C18H26N2O/c1-2-3-4-5-6-14-18(21)20-19-17-13-9-11-15-10-7-8-12-16(15)17/h7-8,10,12H,2-6,9,11,13-14H2,1H3,(H,20,21)/b19-17-
InChIKeyPUQUMLUUZQBQRQ-ZPHPHTNESA-N
MW286.42 g/mol
LogP4.20
Rot. Bonds7

About N-[(Z)-3,4-dihydro-2H-naphthalen-1-ylideneamino]octanamide

N-[(Z)-3,4-dihydro-2H-naphthalen-1-ylideneamino]octanamide (PubChem CID 6297520) has the molecular formula C18H26N2O and a molecular weight of 286.42 g/mol. Its IUPAC name is N-[(Z)-3,4-dihydro-2H-naphthalen-1-ylideneamino]octanamide.

Molecular Properties

Compound NameN-[(Z)-3,4-dihydro-2H-naphthalen-1-ylideneamino]octanamide
PubChem CID6297520
Molecular FormulaC18H26N2O
Molecular Weight286.42 g/mol
Exact Mass286.20
IUPAC NameN-[(Z)-3,4-dihydro-2H-naphthalen-1-ylideneamino]octanamide
SMILESCCCCCCCC(=O)N/N=C1/CCCc2ccccc21
InChIInChI=1S/C18H26N2O/c1-2-3-4-5-6-14-18(21)20-19-17-13-9-11-15-10-7-8-12-16(15)17/h7-8,10,12H,2-6,9,11,13-14H2,1H3,(H,20,21)/b19-17-
InChIKeyPUQUMLUUZQBQRQ-ZPHPHTNESA-N
XLogP4.20
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.42
LogP ≤ 54.20
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-(3,4-dihydro-2H-naphthalen-1-ylideneamino)heptanamide
CID 4097852
N-[(Z)-3,4-dihydro-2H-naphthalen-1-ylideneamino]hexanamide
CID 6031534
N-[(Z)-3,4-dihydro-2H-naphthalen-1-ylideneamino]-2-phenylacetamide
CID 5395791
N-[(E)-3,4-dihydro-2H-naphthalen-1-ylideneamino]-2-(2-methoxyanilino)acetamide
CID 6071350
N-(cyclododecylideneamino)dodecanamide
CID 4575376
N-(3,4-dihydro-2H-naphthalen-1-ylideneamino)-2-(2-propan-2-ylphenoxy)acetamide
CID 922588
N-(3,4-dihydro-2H-naphthalen-1-ylideneamino)-2-hydroxybenzamide
CID 4999116
2-N,5-N-bis(3,4-dihydro-2H-naphthalen-1-ylideneamino)furan-2,5-dicarboxamide
CID 3419131
2-(4-bromo-3-methylphenoxy)-N-[(Z)-3,4-dihydro-2H-naphthalen-1-ylideneamino]acetamide
CID 6528002
N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]dodecanamide
CID 23624795
N-[(E)-benzylideneamino]heptanamide
CID 6083821
N-(benzylideneamino)decanamide
CID 3430585

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-3,4-dihydro-2H-naphthalen-1-ylideneamino]octanamide?
The IUPAC name of N-[(Z)-3,4-dihydro-2H-naphthalen-1-ylideneamino]octanamide (CID 6297520) is N-[(Z)-3,4-dihydro-2H-naphthalen-1-ylideneamino]octanamide.
What is the SMILES notation for N-[(Z)-3,4-dihydro-2H-naphthalen-1-ylideneamino]octanamide?
The canonical SMILES for N-[(Z)-3,4-dihydro-2H-naphthalen-1-ylideneamino]octanamide is CCCCCCCC(=O)N/N=C1/CCCc2ccccc21.
What is the InChIKey of N-[(Z)-3,4-dihydro-2H-naphthalen-1-ylideneamino]octanamide?
The InChIKey is PUQUMLUUZQBQRQ-ZPHPHTNESA-N. The full InChI is InChI=1S/C18H26N2O/c1-2-3-4-5-6-14-18(21)20-19-17-13-9-11-15-10-7-8-12-16(15)17/h7-8,10,12H,2-6,9,11,13-14H2,1H3,(H,20,21)/b19-17-.
What are the key properties of N-[(Z)-3,4-dihydro-2H-naphthalen-1-ylideneamino]octanamide?
N-[(Z)-3,4-dihydro-2H-naphthalen-1-ylideneamino]octanamide has a molecular weight of 286.42 g/mol, XLogP of 4.20, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-3,4-dihydro-2H-naphthalen-1-ylideneamino]octanamide is sourced from PubChem (CID 6297520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).