N-hexylacetamide

C8H17NO — CID 24129

IUPACN-hexylacetamide
SMILESCCCCCCNC(C)=O
InChIInChI=1S/C8H17NO/c1-3-4-5-6-7-9-8(2)10/h3-7H2,1-2H3,(H,9,10)
InChIKeySYIOXNGUUYGIIF-UHFFFAOYSA-N
MW143.23 g/mol
LogP1.70
Rot. Bonds5

About N-hexylacetamide

N-hexylacetamide (PubChem CID 24129) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is N-hexylacetamide.

Molecular Properties

Compound NameN-hexylacetamide
PubChem CID24129
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC NameN-hexylacetamide
SMILESCCCCCCNC(C)=O
InChIInChI=1S/C8H17NO/c1-3-4-5-6-7-9-8(2)10/h3-7H2,1-2H3,(H,9,10)
InChIKeySYIOXNGUUYGIIF-UHFFFAOYSA-N
XLogP1.70
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-nonadecylacetamide
CID 54574805
N-pentadecylacetamide
CID 12009452
N-[5-[5-(hexylamino)pentylamino]pentyl]acetamide
CID 58435545
N-butylacetamide;molecular hydrogen
CID 142252069
N-(4-oxotetradecyl)acetamide
CID 164678896
N,N'-diheptyloxamide
CID 3417538
N-butylacetamide;propanoic acid
CID 87146552
N-(3-acetamidopropyl)acetamide
CID 5147555
5-acetamido-N-butylpentanamide
CID 123729472
dodecyl 6-acetamidohexanoate
CID 21259378
N-butylacetamide;ethane;N-pentylacetamide;bis(2H-triazole)
CID 91482407
N-hexadecyl-N'-[2-[[2-(hexadecylamino)-2-oxoacetyl]amino]ethyl]oxamide
CID 154464806

Frequently Asked Questions

What is the IUPAC name of N-hexylacetamide?
The IUPAC name of N-hexylacetamide (CID 24129) is N-hexylacetamide.
What is the SMILES notation for N-hexylacetamide?
The canonical SMILES for N-hexylacetamide is CCCCCCNC(C)=O.
What is the InChIKey of N-hexylacetamide?
The InChIKey is SYIOXNGUUYGIIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO/c1-3-4-5-6-7-9-8(2)10/h3-7H2,1-2H3,(H,9,10).
What are the key properties of N-hexylacetamide?
N-hexylacetamide has a molecular weight of 143.23 g/mol, XLogP of 1.70, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-hexylacetamide is sourced from PubChem (CID 24129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).