N-(hexan-2-ylideneamino)-2-naphthalen-1-ylacetamide

C18H22N2O — CID 4066378

IUPACN-(hexan-2-ylideneamino)-2-naphthalen-1-ylacetamide
SMILESCCCCC(C)=NNC(=O)Cc1cccc2ccccc12
InChIInChI=1S/C18H22N2O/c1-3-4-8-14(2)19-20-18(21)13-16-11-7-10-15-9-5-6-12-17(15)16/h5-7,9-12H,3-4,8,13H2,1-2H3,(H,20,21)
InChIKeyOJBZPKXROGOODS-UHFFFAOYSA-N
MW282.39 g/mol
LogP4.06
Rot. Bonds6

About N-(hexan-2-ylideneamino)-2-naphthalen-1-ylacetamide

N-(hexan-2-ylideneamino)-2-naphthalen-1-ylacetamide (PubChem CID 4066378) has the molecular formula C18H22N2O and a molecular weight of 282.39 g/mol. Its IUPAC name is N-(hexan-2-ylideneamino)-2-naphthalen-1-ylacetamide.

Molecular Properties

Compound NameN-(hexan-2-ylideneamino)-2-naphthalen-1-ylacetamide
PubChem CID4066378
Molecular FormulaC18H22N2O
Molecular Weight282.39 g/mol
Exact Mass282.17
IUPAC NameN-(hexan-2-ylideneamino)-2-naphthalen-1-ylacetamide
SMILESCCCCC(C)=NNC(=O)Cc1cccc2ccccc12
InChIInChI=1S/C18H22N2O/c1-3-4-8-14(2)19-20-18(21)13-16-11-7-10-15-9-5-6-12-17(15)16/h5-7,9-12H,3-4,8,13H2,1-2H3,(H,20,21)
InChIKeyOJBZPKXROGOODS-UHFFFAOYSA-N
XLogP4.06
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

ethyl 3-[(2-naphthalen-1-ylacetyl)hydrazinylidene]butanoate
CID 3402197
N-[(Z)-[4-(naphthalen-1-ylamino)-4-oxobutan-2-ylidene]amino]pentanamide
CID 171979194
N-(hexan-2-ylideneamino)-2-(4-methoxyphenyl)acetamide
CID 3778528
N-butyl-2-naphthalen-1-ylacetamide
CID 56993604
[(Z)-1-naphthalen-1-ylpropan-2-ylideneamino]urea
CID 5385660
N-[(E)-1-(4-hydroxyphenyl)propylideneamino]-2-naphthalen-1-ylacetamide
CID 135588935
N-[1-(4-methylphenyl)propylideneamino]-2-naphthalen-1-ylacetamide
CID 4153333
2-naphthalen-1-yl-N-octadecylacetamide
CID 71334923
N-[(Z)-hexan-2-ylideneamino]-2-(4-phenyl-1,3-thiazol-2-yl)acetamide
CID 8881024
N-(4-butylphenyl)-2-naphthalen-1-ylacetamide
CID 7314094
N-[1-(1-adamantyl)ethylideneamino]-2-naphthalen-1-ylacetamide
CID 4667670
N-[(Z)-1-(2,4-dihydroxyphenyl)ethylideneamino]-2-naphthalen-1-ylacetamide
CID 137166775

Frequently Asked Questions

What is the IUPAC name of N-(hexan-2-ylideneamino)-2-naphthalen-1-ylacetamide?
The IUPAC name of N-(hexan-2-ylideneamino)-2-naphthalen-1-ylacetamide (CID 4066378) is N-(hexan-2-ylideneamino)-2-naphthalen-1-ylacetamide.
What is the SMILES notation for N-(hexan-2-ylideneamino)-2-naphthalen-1-ylacetamide?
The canonical SMILES for N-(hexan-2-ylideneamino)-2-naphthalen-1-ylacetamide is CCCCC(C)=NNC(=O)Cc1cccc2ccccc12.
What is the InChIKey of N-(hexan-2-ylideneamino)-2-naphthalen-1-ylacetamide?
The InChIKey is OJBZPKXROGOODS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O/c1-3-4-8-14(2)19-20-18(21)13-16-11-7-10-15-9-5-6-12-17(15)16/h5-7,9-12H,3-4,8,13H2,1-2H3,(H,20,21).
What are the key properties of N-(hexan-2-ylideneamino)-2-naphthalen-1-ylacetamide?
N-(hexan-2-ylideneamino)-2-naphthalen-1-ylacetamide has a molecular weight of 282.39 g/mol, XLogP of 4.06, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(hexan-2-ylideneamino)-2-naphthalen-1-ylacetamide is sourced from PubChem (CID 4066378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).