N-ethyl-2-[[2-(trifluoromethyl)phenyl]methylamino]acetamide

C12H15F3N2O — CID 43398909

IUPACN-ethyl-2-[[2-(trifluoromethyl)phenyl]methylamino]acetamide
SMILESCCNC(=O)CNCc1ccccc1C(F)(F)F
InChIInChI=1S/C12H15F3N2O/c1-2-17-11(18)8-16-7-9-5-3-4-6-10(9)12(13,14)15/h3-6,16H,2,7-8H2,1H3,(H,17,18)
InChIKeyJWWOSCPYBLSCGK-UHFFFAOYSA-N
MW260.26 g/mol
LogP1.93
Rot. Bonds5

About N-ethyl-2-[[2-(trifluoromethyl)phenyl]methylamino]acetamide

N-ethyl-2-[[2-(trifluoromethyl)phenyl]methylamino]acetamide (PubChem CID 43398909) has the molecular formula C12H15F3N2O and a molecular weight of 260.26 g/mol. Its IUPAC name is N-ethyl-2-[[2-(trifluoromethyl)phenyl]methylamino]acetamide.

Molecular Properties

Compound NameN-ethyl-2-[[2-(trifluoromethyl)phenyl]methylamino]acetamide
PubChem CID43398909
Molecular FormulaC12H15F3N2O
Molecular Weight260.26 g/mol
Exact Mass260.11
IUPAC NameN-ethyl-2-[[2-(trifluoromethyl)phenyl]methylamino]acetamide
SMILESCCNC(=O)CNCc1ccccc1C(F)(F)F
InChIInChI=1S/C12H15F3N2O/c1-2-17-11(18)8-16-7-9-5-3-4-6-10(9)12(13,14)15/h3-6,16H,2,7-8H2,1H3,(H,17,18)
InChIKeyJWWOSCPYBLSCGK-UHFFFAOYSA-N
XLogP1.93
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.26
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(ethylamino)-N-[[2-(trifluoromethyl)phenyl]methyl]acetamide
CID 55129029
N-(2,2,2-trifluoroethyl)-2-[[2-(trifluoromethyl)phenyl]methylamino]acetamide
CID 60957323
N-methyl-2-[[2-(trifluoromethyl)phenyl]methylamino]acetamide
CID 43214376
2-(2-methoxyethylamino)-N-[[2-(trifluoromethyl)phenyl]methyl]acetamide
CID 79282836
N-ethyl-2-[(2-pyrrolidin-1-ylphenyl)methylamino]acetamide
CID 43221678
butyl 2-[[2-(trifluoromethyl)phenyl]methylamino]acetate
CID 62879426
2-chloro-N-[[2-(trifluoromethyl)phenyl]methyl]acetamide
CID 57455734
2-[2-oxo-2-[[2-(trifluoromethyl)phenyl]methylamino]ethyl]sulfanylacetic acid
CID 115580456
2-sulfanyl-N-[[2-(trifluoromethyl)phenyl]methyl]propanamide
CID 107028778
2-amino-N-[[2-(trifluoromethyl)phenyl]methyl]propanamide
CID 62879781
3-methoxy-N-[[2-(trifluoromethyl)phenyl]methyl]propanamide
CID 110480450
1-(2-hydroxypropyl)-3-[[2-(trifluoromethyl)phenyl]methyl]urea
CID 117235456

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[[2-(trifluoromethyl)phenyl]methylamino]acetamide?
The IUPAC name of N-ethyl-2-[[2-(trifluoromethyl)phenyl]methylamino]acetamide (CID 43398909) is N-ethyl-2-[[2-(trifluoromethyl)phenyl]methylamino]acetamide.
What is the SMILES notation for N-ethyl-2-[[2-(trifluoromethyl)phenyl]methylamino]acetamide?
The canonical SMILES for N-ethyl-2-[[2-(trifluoromethyl)phenyl]methylamino]acetamide is CCNC(=O)CNCc1ccccc1C(F)(F)F.
What is the InChIKey of N-ethyl-2-[[2-(trifluoromethyl)phenyl]methylamino]acetamide?
The InChIKey is JWWOSCPYBLSCGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15F3N2O/c1-2-17-11(18)8-16-7-9-5-3-4-6-10(9)12(13,14)15/h3-6,16H,2,7-8H2,1H3,(H,17,18).
What are the key properties of N-ethyl-2-[[2-(trifluoromethyl)phenyl]methylamino]acetamide?
N-ethyl-2-[[2-(trifluoromethyl)phenyl]methylamino]acetamide has a molecular weight of 260.26 g/mol, XLogP of 1.93, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[[2-(trifluoromethyl)phenyl]methylamino]acetamide is sourced from PubChem (CID 43398909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).