tridecanamide

C13H27NO — CID 4167542

IUPACtridecanamide
SMILESCCCCCCCCCCCCC(N)=O
InChIInChI=1S/C13H27NO/c1-2-3-4-5-6-7-8-9-10-11-12-13(14)15/h2-12H2,1H3,(H2,14,15)
InChIKeyRSSGSPAYFRXVKG-UHFFFAOYSA-N
MW213.36 g/mol
LogP3.78
Rot. Bonds11

About tridecanamide

tridecanamide (PubChem CID 4167542) has the molecular formula C13H27NO and a molecular weight of 213.36 g/mol. Its IUPAC name is tridecanamide.

Molecular Properties

Compound Nametridecanamide
PubChem CID4167542
Molecular FormulaC13H27NO
Molecular Weight213.36 g/mol
Exact Mass213.21
IUPAC Nametridecanamide
SMILESCCCCCCCCCCCCC(N)=O
InChIInChI=1S/C13H27NO/c1-2-3-4-5-6-7-8-9-10-11-12-13(14)15/h2-12H2,1H3,(H2,14,15)
InChIKeyRSSGSPAYFRXVKG-UHFFFAOYSA-N
XLogP3.78
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.36
LogP ≤ 53.78
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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Frequently Asked Questions

What is the IUPAC name of tridecanamide?
The IUPAC name of tridecanamide (CID 4167542) is tridecanamide.
What is the SMILES notation for tridecanamide?
The canonical SMILES for tridecanamide is CCCCCCCCCCCCC(N)=O.
What is the InChIKey of tridecanamide?
The InChIKey is RSSGSPAYFRXVKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27NO/c1-2-3-4-5-6-7-8-9-10-11-12-13(14)15/h2-12H2,1H3,(H2,14,15).
What are the key properties of tridecanamide?
tridecanamide has a molecular weight of 213.36 g/mol, XLogP of 3.78, 11 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tridecanamide is sourced from PubChem (CID 4167542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).