N'-ethyldodecanediamide

C14H28N2O2 — CID 175230920

IUPACN'-ethyldodecanediamide
SMILESCCNC(=O)CCCCCCCCCCC(N)=O
InChIInChI=1S/C14H28N2O2/c1-2-16-14(18)12-10-8-6-4-3-5-7-9-11-13(15)17/h2-12H2,1H3,(H2,15,17)(H,16,18)
InChIKeyJQVQGDCOGUQRJU-UHFFFAOYSA-N
MW256.39 g/mol
LogP2.51
Rot. Bonds12

About N'-ethyldodecanediamide

N'-ethyldodecanediamide (PubChem CID 175230920) has the molecular formula C14H28N2O2 and a molecular weight of 256.39 g/mol. Its IUPAC name is N'-ethyldodecanediamide.

Molecular Properties

Compound NameN'-ethyldodecanediamide
PubChem CID175230920
Molecular FormulaC14H28N2O2
Molecular Weight256.39 g/mol
Exact Mass256.22
IUPAC NameN'-ethyldodecanediamide
SMILESCCNC(=O)CCCCCCCCCCC(N)=O
InChIInChI=1S/C14H28N2O2/c1-2-16-14(18)12-10-8-6-4-3-5-7-9-11-13(15)17/h2-12H2,1H3,(H2,15,17)(H,16,18)
InChIKeyJQVQGDCOGUQRJU-UHFFFAOYSA-N
XLogP2.51
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds12
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 52.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N'-ethylnonanediamide
CID 18377762
N-ethyloctadecanamide;octadecanamide
CID 159879248
N,N'-diethylnonanediamide
CID 89048639
(Z)-N-ethyldocos-13-enamide;(Z)-octadec-9-enamide
CID 175513367
N-ethylhexadecanamide
CID 18377756
N-ethyltridecanamide
CID 23297417
20-(ethylamino)-20-oxoicosanoic acid
CID 59533791
22-(docosanoylamino)docosanamide
CID 90926402
hexadecanamide;N-octadecyloctadecanamide
CID 174792473
N'-docosyldocosanediamide
CID 91257562
N'-octylhexanediamide
CID 18377759
N-(3-amino-3-oxopropyl)octadecanamide
CID 57257667

Frequently Asked Questions

What is the IUPAC name of N'-ethyldodecanediamide?
The IUPAC name of N'-ethyldodecanediamide (CID 175230920) is N'-ethyldodecanediamide.
What is the SMILES notation for N'-ethyldodecanediamide?
The canonical SMILES for N'-ethyldodecanediamide is CCNC(=O)CCCCCCCCCCC(N)=O.
What is the InChIKey of N'-ethyldodecanediamide?
The InChIKey is JQVQGDCOGUQRJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2/c1-2-16-14(18)12-10-8-6-4-3-5-7-9-11-13(15)17/h2-12H2,1H3,(H2,15,17)(H,16,18).
What are the key properties of N'-ethyldodecanediamide?
N'-ethyldodecanediamide has a molecular weight of 256.39 g/mol, XLogP of 2.51, 12 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-ethyldodecanediamide is sourced from PubChem (CID 175230920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).