N,N-dipropyl-2-(2,3,4-trifluoroanilino)acetamide

C14H19F3N2O — CID 109006692

IUPACN,N-dipropyl-2-(2,3,4-trifluoroanilino)acetamide
SMILESCCCN(CCC)C(=O)CNc1ccc(F)c(F)c1F
InChIInChI=1S/C14H19F3N2O/c1-3-7-19(8-4-2)12(20)9-18-11-6-5-10(15)13(16)14(11)17/h5-6,18H,3-4,7-9H2,1-2H3
InChIKeyNYOPNFZRFGDJCI-UHFFFAOYSA-N
MW288.31 g/mol
LogP3.16
Rot. Bonds7

About N,N-dipropyl-2-(2,3,4-trifluoroanilino)acetamide

N,N-dipropyl-2-(2,3,4-trifluoroanilino)acetamide (PubChem CID 109006692) has the molecular formula C14H19F3N2O and a molecular weight of 288.31 g/mol. Its IUPAC name is N,N-dipropyl-2-(2,3,4-trifluoroanilino)acetamide.

Molecular Properties

Compound NameN,N-dipropyl-2-(2,3,4-trifluoroanilino)acetamide
PubChem CID109006692
Molecular FormulaC14H19F3N2O
Molecular Weight288.31 g/mol
Exact Mass288.14
IUPAC NameN,N-dipropyl-2-(2,3,4-trifluoroanilino)acetamide
SMILESCCCN(CCC)C(=O)CNc1ccc(F)c(F)c1F
InChIInChI=1S/C14H19F3N2O/c1-3-7-19(8-4-2)12(20)9-18-11-6-5-10(15)13(16)14(11)17/h5-6,18H,3-4,7-9H2,1-2H3
InChIKeyNYOPNFZRFGDJCI-UHFFFAOYSA-N
XLogP3.16
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.31
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}

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Related Compounds

2-(2-chloroanilino)-N-[2-oxo-2-(2,3,4-trifluoroanilino)ethyl]-N-propylacetamide
CID 55437591
2-(4-bromo-2-methylanilino)-N,N-dipropylacetamide
CID 109006671
N-methyl-2-(2,3,4-trifluoroanilino)acetamide
CID 28574383
N-methyl-N-(2-pyridin-4-ylethyl)-2-(2,3,4-trifluoroanilino)acetamide
CID 109001618
N-[2-(dimethylamino)ethyl]-2-(2,3,4-trifluoroanilino)acetamide
CID 108994740
2,3,4-trifluoro-N-(2-methylidenebutyl)aniline
CID 66045918
N,N-dipropyl-5-(2,3,4-trifluoroanilino)pyrazine-2-carboxamide
CID 109289002
2-(4-bromoanilino)-N,N-dipropylacetamide
CID 39453454
2-(2,6-diethylanilino)-N,N-dipropylacetamide
CID 109006644
N-[2-oxo-2-(2,3,4-trifluoroanilino)ethyl]-N-propylpyridine-4-carboxamide
CID 27773073
4-iodo-N-[2-oxo-2-(2,3,4-trifluoroanilino)ethyl]-N-propylbenzamide
CID 27773080
2-(2-chloro-6-fluorophenyl)-N-[2-oxo-2-(2,3,4-trifluoroanilino)ethyl]-N-propylacetamide
CID 24677447

Frequently Asked Questions

What is the IUPAC name of N,N-dipropyl-2-(2,3,4-trifluoroanilino)acetamide?
The IUPAC name of N,N-dipropyl-2-(2,3,4-trifluoroanilino)acetamide (CID 109006692) is N,N-dipropyl-2-(2,3,4-trifluoroanilino)acetamide.
What is the SMILES notation for N,N-dipropyl-2-(2,3,4-trifluoroanilino)acetamide?
The canonical SMILES for N,N-dipropyl-2-(2,3,4-trifluoroanilino)acetamide is CCCN(CCC)C(=O)CNc1ccc(F)c(F)c1F.
What is the InChIKey of N,N-dipropyl-2-(2,3,4-trifluoroanilino)acetamide?
The InChIKey is NYOPNFZRFGDJCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19F3N2O/c1-3-7-19(8-4-2)12(20)9-18-11-6-5-10(15)13(16)14(11)17/h5-6,18H,3-4,7-9H2,1-2H3.
What are the key properties of N,N-dipropyl-2-(2,3,4-trifluoroanilino)acetamide?
N,N-dipropyl-2-(2,3,4-trifluoroanilino)acetamide has a molecular weight of 288.31 g/mol, XLogP of 3.16, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dipropyl-2-(2,3,4-trifluoroanilino)acetamide is sourced from PubChem (CID 109006692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).