N-dodecylacetamide

C14H29NO — CID 19764

IUPACN-dodecylacetamide
SMILESCCCCCCCCCCCCNC(C)=O
InChIInChI=1S/C14H29NO/c1-3-4-5-6-7-8-9-10-11-12-13-15-14(2)16/h3-13H2,1-2H3,(H,15,16)
InChIKeyMDYPFOFSXHBHFE-UHFFFAOYSA-N
MW227.39 g/mol
LogP4.04
Rot. Bonds11

About N-dodecylacetamide

N-dodecylacetamide (PubChem CID 19764) has the molecular formula C14H29NO and a molecular weight of 227.39 g/mol. Its IUPAC name is N-dodecylacetamide.

Molecular Properties

Compound NameN-dodecylacetamide
PubChem CID19764
Molecular FormulaC14H29NO
Molecular Weight227.39 g/mol
Exact Mass227.22
IUPAC NameN-dodecylacetamide
SMILESCCCCCCCCCCCCNC(C)=O
InChIInChI=1S/C14H29NO/c1-3-4-5-6-7-8-9-10-11-12-13-15-14(2)16/h3-13H2,1-2H3,(H,15,16)
InChIKeyMDYPFOFSXHBHFE-UHFFFAOYSA-N
XLogP4.04
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.39
LogP ≤ 54.04
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-dodecylacetamide?
The IUPAC name of N-dodecylacetamide (CID 19764) is N-dodecylacetamide.
What is the SMILES notation for N-dodecylacetamide?
The canonical SMILES for N-dodecylacetamide is CCCCCCCCCCCCNC(C)=O.
What is the InChIKey of N-dodecylacetamide?
The InChIKey is MDYPFOFSXHBHFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29NO/c1-3-4-5-6-7-8-9-10-11-12-13-15-14(2)16/h3-13H2,1-2H3,(H,15,16).
What are the key properties of N-dodecylacetamide?
N-dodecylacetamide has a molecular weight of 227.39 g/mol, XLogP of 4.04, 11 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-dodecylacetamide is sourced from PubChem (CID 19764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).