N-[2-(dimethylamino)ethyl]dodecanamide

C16H34N2O — CID 4644625

IUPACN-[2-(dimethylamino)ethyl]dodecanamide
SMILESCCCCCCCCCCCC(=O)NCCN(C)C
InChIInChI=1S/C16H34N2O/c1-4-5-6-7-8-9-10-11-12-13-16(19)17-14-15-18(2)3/h4-15H2,1-3H3,(H,17,19)
InChIKeyKXFJXWOTQMPQNI-UHFFFAOYSA-N
MW270.46 g/mol
LogP3.59
Rot. Bonds13

About N-[2-(dimethylamino)ethyl]dodecanamide

N-[2-(dimethylamino)ethyl]dodecanamide (PubChem CID 4644625) has the molecular formula C16H34N2O and a molecular weight of 270.46 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]dodecanamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]dodecanamide
PubChem CID4644625
Molecular FormulaC16H34N2O
Molecular Weight270.46 g/mol
Exact Mass270.27
IUPAC NameN-[2-(dimethylamino)ethyl]dodecanamide
SMILESCCCCCCCCCCCC(=O)NCCN(C)C
InChIInChI=1S/C16H34N2O/c1-4-5-6-7-8-9-10-11-12-13-16(19)17-14-15-18(2)3/h4-15H2,1-3H3,(H,17,19)
InChIKeyKXFJXWOTQMPQNI-UHFFFAOYSA-N
XLogP3.59
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds13
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.46
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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-[2-(dimethylamino)ethyl]dodecanamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]dodecanamide (CID 4644625) is N-[2-(dimethylamino)ethyl]dodecanamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]dodecanamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]dodecanamide is CCCCCCCCCCCC(=O)NCCN(C)C.
What is the InChIKey of N-[2-(dimethylamino)ethyl]dodecanamide?
The InChIKey is KXFJXWOTQMPQNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N2O/c1-4-5-6-7-8-9-10-11-12-13-16(19)17-14-15-18(2)3/h4-15H2,1-3H3,(H,17,19).
What are the key properties of N-[2-(dimethylamino)ethyl]dodecanamide?
N-[2-(dimethylamino)ethyl]dodecanamide has a molecular weight of 270.46 g/mol, XLogP of 3.59, 13 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]dodecanamide is sourced from PubChem (CID 4644625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).