N,N-diethyl-2-(trifluoromethyl)decanamide

C15H28F3NO — CID 87943520

IUPACN,N-diethyl-2-(trifluoromethyl)decanamide
SMILESCCCCCCCCC(C(=O)N(CC)CC)C(F)(F)F
InChIInChI=1S/C15H28F3NO/c1-4-7-8-9-10-11-12-13(15(16,17)18)14(20)19(5-2)6-3/h13H,4-12H2,1-3H3
InChIKeyMJVZUNCERNBFDX-UHFFFAOYSA-N
MW295.39 g/mol
LogP4.78
Rot. Bonds10

About N,N-diethyl-2-(trifluoromethyl)decanamide

N,N-diethyl-2-(trifluoromethyl)decanamide (PubChem CID 87943520) has the molecular formula C15H28F3NO and a molecular weight of 295.39 g/mol. Its IUPAC name is N,N-diethyl-2-(trifluoromethyl)decanamide.

Molecular Properties

Compound NameN,N-diethyl-2-(trifluoromethyl)decanamide
PubChem CID87943520
Molecular FormulaC15H28F3NO
Molecular Weight295.39 g/mol
Exact Mass295.21
IUPAC NameN,N-diethyl-2-(trifluoromethyl)decanamide
SMILESCCCCCCCCC(C(=O)N(CC)CC)C(F)(F)F
InChIInChI=1S/C15H28F3NO/c1-4-7-8-9-10-11-12-13(15(16,17)18)14(20)19(5-2)6-3/h13H,4-12H2,1-3H3
InChIKeyMJVZUNCERNBFDX-UHFFFAOYSA-N
XLogP4.78
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.39
LogP ≤ 54.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N,N-diethyl-2-(trifluoromethyl)nonanamide
CID 87943381
2-(trifluoromethyl)hexadecanoyl fluoride
CID 175023315
N,N-diethyl-2-octyldodecanamide
CID 54517458
butyl 2-(trifluoromethyl)octanoate
CID 87943129
propyl 2-(trifluoromethyl)nonanoate
CID 87943473
N,N-diethyl-2,3,3,3-tetrafluoropropanamide
CID 2774042
N,N-dibutyl-5-oxo-2-(trifluoromethyl)heptanamide
CID 15438697
5-(trifluoromethyl)undecan-6-one
CID 14914268
N,N,N',N'-tetraethyl-2,8-bis(hexadec-7-enyl)nonanediamide
CID 91497210
N-ethyl-N-hexylcarbamate
CID 53442022
N,N,N',N'-tetraethyl-2,8-bis[8-[(2S,3S)-3-octyloxiran-2-yl]octyl]nonanediamide
CID 90908048
N-pentylsulfanyl-2-(trifluoromethyl)heptanamide
CID 174529612

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-(trifluoromethyl)decanamide?
The IUPAC name of N,N-diethyl-2-(trifluoromethyl)decanamide (CID 87943520) is N,N-diethyl-2-(trifluoromethyl)decanamide.
What is the SMILES notation for N,N-diethyl-2-(trifluoromethyl)decanamide?
The canonical SMILES for N,N-diethyl-2-(trifluoromethyl)decanamide is CCCCCCCCC(C(=O)N(CC)CC)C(F)(F)F.
What is the InChIKey of N,N-diethyl-2-(trifluoromethyl)decanamide?
The InChIKey is MJVZUNCERNBFDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28F3NO/c1-4-7-8-9-10-11-12-13(15(16,17)18)14(20)19(5-2)6-3/h13H,4-12H2,1-3H3.
What are the key properties of N,N-diethyl-2-(trifluoromethyl)decanamide?
N,N-diethyl-2-(trifluoromethyl)decanamide has a molecular weight of 295.39 g/mol, XLogP of 4.78, 10 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-(trifluoromethyl)decanamide is sourced from PubChem (CID 87943520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).