hexanamide

C6H13NO — CID 12332

IUPAChexanamide
SMILESCCCCCC(N)=O
InChIInChI=1S/C6H13NO/c1-2-3-4-5-6(7)8/h2-5H2,1H3,(H2,7,8)
InChIKeyALBYIUDWACNRRB-UHFFFAOYSA-N
MW115.18 g/mol
LogP1.05
Rot. Bonds4

About hexanamide

hexanamide (PubChem CID 12332) has the molecular formula C6H13NO and a molecular weight of 115.18 g/mol. Its IUPAC name is hexanamide.

Molecular Properties

Compound Namehexanamide
PubChem CID12332
Molecular FormulaC6H13NO
Molecular Weight115.18 g/mol
Exact Mass115.10
IUPAC Namehexanamide
SMILESCCCCCC(N)=O
InChIInChI=1S/C6H13NO/c1-2-3-4-5-6(7)8/h2-5H2,1H3,(H2,7,8)
InChIKeyALBYIUDWACNRRB-UHFFFAOYSA-N
XLogP1.05
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.18
LogP ≤ 51.05
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

Hexanediamide
CID 12364
Dodecanamide
CID 14256
Hexanohydroxamic acid
CID 78005
Tetradecanamide
CID 69492
Nonanamide
CID 70709
Heptanamide
CID 136449
Pentanamide
CID 12298
Octanamide
CID 69414
Decanamide
CID 75347
Tridecanamide
CID 4167542
Undecanamide
CID 256598
Hexanamide, 6-amino-
CID 67798

Frequently Asked Questions

What is the IUPAC name of hexanamide?
The IUPAC name of hexanamide (CID 12332) is hexanamide.
What is the SMILES notation for hexanamide?
The canonical SMILES for hexanamide is CCCCCC(N)=O.
What is the InChIKey of hexanamide?
The InChIKey is ALBYIUDWACNRRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO/c1-2-3-4-5-6(7)8/h2-5H2,1H3,(H2,7,8).
What are the key properties of hexanamide?
hexanamide has a molecular weight of 115.18 g/mol, XLogP of 1.05, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for hexanamide is sourced from PubChem (CID 12332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).