2-butyltetradecanamide

C18H37NO — CID 57191211

IUPAC2-butyltetradecanamide
SMILESCCCCCCCCCCCCC(CCCC)C(N)=O
InChIInChI=1S/C18H37NO/c1-3-5-7-8-9-10-11-12-13-14-16-17(18(19)20)15-6-4-2/h17H,3-16H2,1-2H3,(H2,19,20)
InChIKeyIFEXGAAFPOCARF-UHFFFAOYSA-N
MW283.50 g/mol
LogP5.59
Rot. Bonds15

About 2-butyltetradecanamide

2-butyltetradecanamide (PubChem CID 57191211) has the molecular formula C18H37NO and a molecular weight of 283.50 g/mol. Its IUPAC name is 2-butyltetradecanamide.

Molecular Properties

Compound Name2-butyltetradecanamide
PubChem CID57191211
Molecular FormulaC18H37NO
Molecular Weight283.50 g/mol
Exact Mass283.29
IUPAC Name2-butyltetradecanamide
SMILESCCCCCCCCCCCCC(CCCC)C(N)=O
InChIInChI=1S/C18H37NO/c1-3-5-7-8-9-10-11-12-13-14-16-17(18(19)20)15-6-4-2/h17H,3-16H2,1-2H3,(H2,19,20)
InChIKeyIFEXGAAFPOCARF-UHFFFAOYSA-N
XLogP5.59
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds15
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500283.50
LogP ≤ 55.59
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

2-butyldodecanamide
CID 88685822
2,9-dibutyldecanediamide
CID 141080467
2-hexyloctanamide
CID 87302701
2-octyldecanamide
CID 19104479
2-dodecylnonadecanamide
CID 175503182
acetic acid;2-butylhexadecanamide
CID 174441858
ethene;2-hexadecyloctadecanamide
CID 87836706
2-undecylhexanediamide
CID 174629940
2-(2-hydroxyethyl)tetradecanamide
CID 154187361
2-propylhexanamide
CID 19818979
azane;2-ethyldodecanamide
CID 174462460
2-hexadecylicos-11-enamide
CID 173011844

Frequently Asked Questions

What is the IUPAC name of 2-butyltetradecanamide?
The IUPAC name of 2-butyltetradecanamide (CID 57191211) is 2-butyltetradecanamide.
What is the SMILES notation for 2-butyltetradecanamide?
The canonical SMILES for 2-butyltetradecanamide is CCCCCCCCCCCCC(CCCC)C(N)=O.
What is the InChIKey of 2-butyltetradecanamide?
The InChIKey is IFEXGAAFPOCARF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H37NO/c1-3-5-7-8-9-10-11-12-13-14-16-17(18(19)20)15-6-4-2/h17H,3-16H2,1-2H3,(H2,19,20).
What are the key properties of 2-butyltetradecanamide?
2-butyltetradecanamide has a molecular weight of 283.50 g/mol, XLogP of 5.59, 15 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butyltetradecanamide is sourced from PubChem (CID 57191211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).