2-(ethylamino)-2-methyl-N-octylpropanamide

C14H30N2O — CID 113337256

IUPAC2-(ethylamino)-2-methyl-N-octylpropanamide
SMILESCCCCCCCCNC(=O)C(C)(C)NCC
InChIInChI=1S/C14H30N2O/c1-5-7-8-9-10-11-12-15-13(17)14(3,4)16-6-2/h16H,5-12H2,1-4H3,(H,15,17)
InChIKeyJNVQRQNUZHZLPO-UHFFFAOYSA-N
MW242.41 g/mol
LogP2.85
Rot. Bonds10

About 2-(ethylamino)-2-methyl-N-octylpropanamide

2-(ethylamino)-2-methyl-N-octylpropanamide (PubChem CID 113337256) has the molecular formula C14H30N2O and a molecular weight of 242.41 g/mol. Its IUPAC name is 2-(ethylamino)-2-methyl-N-octylpropanamide.

Molecular Properties

Compound Name2-(ethylamino)-2-methyl-N-octylpropanamide
PubChem CID113337256
Molecular FormulaC14H30N2O
Molecular Weight242.41 g/mol
Exact Mass242.24
IUPAC Name2-(ethylamino)-2-methyl-N-octylpropanamide
SMILESCCCCCCCCNC(=O)C(C)(C)NCC
InChIInChI=1S/C14H30N2O/c1-5-7-8-9-10-11-12-15-13(17)14(3,4)16-6-2/h16H,5-12H2,1-4H3,(H,15,17)
InChIKeyJNVQRQNUZHZLPO-UHFFFAOYSA-N
XLogP2.85
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.41
LogP ≤ 52.85
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

2-(ethylamino)-N-(4-methoxybutyl)-2-methylpropanamide
CID 62834257
2,2-dimethyl-N-tetradecylpropanamide
CID 11220230
2,2,2-trifluoro-N-icosylacetamide
CID 91692791
N-dodecyl-2-(18F)fluoro-2,2-difluoroacetamide
CID 177484696
N-(3-ethenoxypropyl)-2-(ethylamino)-2-methylpropanamide
CID 62837032
2,2,2-trichloro-N-dodecylacetamide
CID 4986291
2,2-dichloro-N-pentylpropanamide
CID 12827689
2-(ethylamino)-2-methyl-N-(2-methylsulfanylethyl)propanamide
CID 63958213
N-(4,4-dimethyltridecyl)-2,2,2-trifluoroacetamide
CID 150813708
3-hydroxy-2,2-dimethyl-N-pentylpropanamide
CID 171795881
2,2,4,4-tetramethyl-N-octylhexanamide
CID 178052018
N-heptyl-2-methyl-2-(prop-2-enoylamino)propanamide
CID 134339729

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-2-methyl-N-octylpropanamide?
The IUPAC name of 2-(ethylamino)-2-methyl-N-octylpropanamide (CID 113337256) is 2-(ethylamino)-2-methyl-N-octylpropanamide.
What is the SMILES notation for 2-(ethylamino)-2-methyl-N-octylpropanamide?
The canonical SMILES for 2-(ethylamino)-2-methyl-N-octylpropanamide is CCCCCCCCNC(=O)C(C)(C)NCC.
What is the InChIKey of 2-(ethylamino)-2-methyl-N-octylpropanamide?
The InChIKey is JNVQRQNUZHZLPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O/c1-5-7-8-9-10-11-12-15-13(17)14(3,4)16-6-2/h16H,5-12H2,1-4H3,(H,15,17).
What are the key properties of 2-(ethylamino)-2-methyl-N-octylpropanamide?
2-(ethylamino)-2-methyl-N-octylpropanamide has a molecular weight of 242.41 g/mol, XLogP of 2.85, 10 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-2-methyl-N-octylpropanamide is sourced from PubChem (CID 113337256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).