N,N-dibutyl-3,3,3-trifluoropropanamide

C11H20F3NO — CID 11379443

IUPACN,N-dibutyl-3,3,3-trifluoropropanamide
SMILESCCCCN(CCCC)C(=O)CC(F)(F)F
InChIInChI=1S/C11H20F3NO/c1-3-5-7-15(8-6-4-2)10(16)9-11(12,13)14/h3-9H2,1-2H3
InChIKeyVFOUOYAJUDWKQV-UHFFFAOYSA-N
MW239.28 g/mol
LogP3.37
Rot. Bonds7

About N,N-dibutyl-3,3,3-trifluoropropanamide

N,N-dibutyl-3,3,3-trifluoropropanamide (PubChem CID 11379443) has the molecular formula C11H20F3NO and a molecular weight of 239.28 g/mol. Its IUPAC name is N,N-dibutyl-3,3,3-trifluoropropanamide.

Molecular Properties

Compound NameN,N-dibutyl-3,3,3-trifluoropropanamide
PubChem CID11379443
Molecular FormulaC11H20F3NO
Molecular Weight239.28 g/mol
Exact Mass239.15
IUPAC NameN,N-dibutyl-3,3,3-trifluoropropanamide
SMILESCCCCN(CCCC)C(=O)CC(F)(F)F
InChIInChI=1S/C11H20F3NO/c1-3-5-7-15(8-6-4-2)10(16)9-11(12,13)14/h3-9H2,1-2H3
InChIKeyVFOUOYAJUDWKQV-UHFFFAOYSA-N
XLogP3.37
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.28
LogP ≤ 53.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N,N-Dibutylpropanamide
CID 70909
N,N-Dibutylacetamide
CID 73811
N,N-Diethylbutanamide
CID 66192
Propanamide, N,N-dipropyl-
CID 70687
Acetamide, N-butyl-N-ethyl-
CID 202537
N,N-Dibutyl-2,2,3,3,4,4,4-heptafluorobutanamide
CID 617533
2,2,3,3,4,4,4-Heptafluoro-N,N-bis(2-methylpropyl)butanamide
CID 4606680
N,N-Diethyl-2,2,3,3,4,4,4-heptafluorobutanamide
CID 5051020
N,N-Dibutylbutanamide
CID 243368
N,N-Diethyl-3,3,3-trifluoro-2-(trifluoromethyl)propanamide
CID 2748458
N,N-Diethyl-2,2,3,3,4,4,5,5,5-nonafluoropentanamide
CID 3660287
N,N-diethyl-2,2,3,3-tetrafluoropropanamide
CID 136233

Frequently Asked Questions

What is the IUPAC name of N,N-dibutyl-3,3,3-trifluoropropanamide?
The IUPAC name of N,N-dibutyl-3,3,3-trifluoropropanamide (CID 11379443) is N,N-dibutyl-3,3,3-trifluoropropanamide.
What is the SMILES notation for N,N-dibutyl-3,3,3-trifluoropropanamide?
The canonical SMILES for N,N-dibutyl-3,3,3-trifluoropropanamide is CCCCN(CCCC)C(=O)CC(F)(F)F.
What is the InChIKey of N,N-dibutyl-3,3,3-trifluoropropanamide?
The InChIKey is VFOUOYAJUDWKQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20F3NO/c1-3-5-7-15(8-6-4-2)10(16)9-11(12,13)14/h3-9H2,1-2H3.
What are the key properties of N,N-dibutyl-3,3,3-trifluoropropanamide?
N,N-dibutyl-3,3,3-trifluoropropanamide has a molecular weight of 239.28 g/mol, XLogP of 3.37, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dibutyl-3,3,3-trifluoropropanamide is sourced from PubChem (CID 11379443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).