2-ethyl-N-(2-ethylhexyl)hexanamide

C16H33NO — CID 4549756

IUPAC2-ethyl-N-(2-ethylhexyl)hexanamide
SMILESCCCCC(CC)CNC(=O)C(CC)CCCC
InChIInChI=1S/C16H33NO/c1-5-9-11-14(7-3)13-17-16(18)15(8-4)12-10-6-2/h14-15H,5-13H2,1-4H3,(H,17,18)
InChIKeyNXLBBKQIOWRQOU-UHFFFAOYSA-N
MW255.45 g/mol
LogP4.54
Rot. Bonds11

About 2-ethyl-N-(2-ethylhexyl)hexanamide

2-ethyl-N-(2-ethylhexyl)hexanamide (PubChem CID 4549756) has the molecular formula C16H33NO and a molecular weight of 255.45 g/mol. Its IUPAC name is 2-ethyl-N-(2-ethylhexyl)hexanamide.

Molecular Properties

Compound Name2-ethyl-N-(2-ethylhexyl)hexanamide
PubChem CID4549756
Molecular FormulaC16H33NO
Molecular Weight255.45 g/mol
Exact Mass255.26
IUPAC Name2-ethyl-N-(2-ethylhexyl)hexanamide
SMILESCCCCC(CC)CNC(=O)C(CC)CCCC
InChIInChI=1S/C16H33NO/c1-5-9-11-14(7-3)13-17-16(18)15(8-4)12-10-6-2/h14-15H,5-13H2,1-4H3,(H,17,18)
InChIKeyNXLBBKQIOWRQOU-UHFFFAOYSA-N
XLogP4.54
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.45
LogP ≤ 54.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-ethyl-N-(2-ethylhexyl)hexanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-Methylpropyl)hexanimidic acid
CID 239248
N-(2-methylpropyl)dodecanamide
CID 345934
Dodecanamide, N-hexyl-
CID 3505480
Isostearamidopropyl Dimethylamine
CID 105621
N-(13-Methyltetradecyl)acetamide
CID 47346
Hexanamide, 2-ethyl-N-methyl-
CID 14216
Dodecanamide, N-butyl-
CID 94896
N-cyclohexanecarbonylpentadecylamine
CID 44398718
N-isobutyloctanamide
CID 230173
N-isobutyl-decanamide
CID 3613503
N-(2-Methylpropyl)hexacosanamide
CID 14162529
N-(cyclohexylmethyl)cyclohexanecarboxamide
CID 4051138

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-(2-ethylhexyl)hexanamide?
The IUPAC name of 2-ethyl-N-(2-ethylhexyl)hexanamide (CID 4549756) is 2-ethyl-N-(2-ethylhexyl)hexanamide.
What is the SMILES notation for 2-ethyl-N-(2-ethylhexyl)hexanamide?
The canonical SMILES for 2-ethyl-N-(2-ethylhexyl)hexanamide is CCCCC(CC)CNC(=O)C(CC)CCCC.
What is the InChIKey of 2-ethyl-N-(2-ethylhexyl)hexanamide?
The InChIKey is NXLBBKQIOWRQOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33NO/c1-5-9-11-14(7-3)13-17-16(18)15(8-4)12-10-6-2/h14-15H,5-13H2,1-4H3,(H,17,18).
What are the key properties of 2-ethyl-N-(2-ethylhexyl)hexanamide?
2-ethyl-N-(2-ethylhexyl)hexanamide has a molecular weight of 255.45 g/mol, XLogP of 4.54, 11 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-(2-ethylhexyl)hexanamide is sourced from PubChem (CID 4549756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).