N-[(E)-prop-1-enyl]dodecanamide

C15H29NO — CID 22051964

IUPACN-[(E)-prop-1-enyl]dodecanamide
SMILESC/C=C/NC(=O)CCCCCCCCCCC
InChIInChI=1S/C15H29NO/c1-3-5-6-7-8-9-10-11-12-13-15(17)16-14-4-2/h4,14H,3,5-13H2,1-2H3,(H,16,17)/b14-4+
InChIKeyOQKPXYLPVLUZRM-LNKIKWGQSA-N
MW239.40 g/mol
LogP4.56
Rot. Bonds11

About N-[(E)-prop-1-enyl]dodecanamide

N-[(E)-prop-1-enyl]dodecanamide (PubChem CID 22051964) has the molecular formula C15H29NO and a molecular weight of 239.40 g/mol. Its IUPAC name is N-[(E)-prop-1-enyl]dodecanamide.

Molecular Properties

Compound NameN-[(E)-prop-1-enyl]dodecanamide
PubChem CID22051964
Molecular FormulaC15H29NO
Molecular Weight239.40 g/mol
Exact Mass239.22
IUPAC NameN-[(E)-prop-1-enyl]dodecanamide
SMILESC/C=C/NC(=O)CCCCCCCCCCC
InChIInChI=1S/C15H29NO/c1-3-5-6-7-8-9-10-11-12-13-15(17)16-14-4-2/h4,14H,3,5-13H2,1-2H3,(H,16,17)/b14-4+
InChIKeyOQKPXYLPVLUZRM-LNKIKWGQSA-N
XLogP4.56
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.40
LogP ≤ 54.56
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 N-[(E)-prop-1-enyl]dodecanamide?
The IUPAC name of N-[(E)-prop-1-enyl]dodecanamide (CID 22051964) is N-[(E)-prop-1-enyl]dodecanamide.
What is the SMILES notation for N-[(E)-prop-1-enyl]dodecanamide?
The canonical SMILES for N-[(E)-prop-1-enyl]dodecanamide is C/C=C/NC(=O)CCCCCCCCCCC.
What is the InChIKey of N-[(E)-prop-1-enyl]dodecanamide?
The InChIKey is OQKPXYLPVLUZRM-LNKIKWGQSA-N. The full InChI is InChI=1S/C15H29NO/c1-3-5-6-7-8-9-10-11-12-13-15(17)16-14-4-2/h4,14H,3,5-13H2,1-2H3,(H,16,17)/b14-4+.
What are the key properties of N-[(E)-prop-1-enyl]dodecanamide?
N-[(E)-prop-1-enyl]dodecanamide has a molecular weight of 239.40 g/mol, XLogP of 4.56, 11 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-prop-1-enyl]dodecanamide is sourced from PubChem (CID 22051964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).