N-ethyl-2-[ethyl-[[4-hydroxy-3-(trifluoromethyl)phenyl]methyl]amino]acetamide

C14H19F3N2O2 — CID 82957049

IUPACN-ethyl-2-[ethyl-[[4-hydroxy-3-(trifluoromethyl)phenyl]methyl]amino]acetamide
SMILESCCNC(=O)CN(CC)Cc1ccc(O)c(C(F)(F)F)c1
InChIInChI=1S/C14H19F3N2O2/c1-3-18-13(21)9-19(4-2)8-10-5-6-12(20)11(7-10)14(15,16)17/h5-7,20H,3-4,8-9H2,1-2H3,(H,18,21)
InChIKeyGGAVJTGPMQNPGH-UHFFFAOYSA-N
MW304.31 g/mol
LogP2.37
Rot. Bonds6

About N-ethyl-2-[ethyl-[[4-hydroxy-3-(trifluoromethyl)phenyl]methyl]amino]acetamide

N-ethyl-2-[ethyl-[[4-hydroxy-3-(trifluoromethyl)phenyl]methyl]amino]acetamide (PubChem CID 82957049) has the molecular formula C14H19F3N2O2 and a molecular weight of 304.31 g/mol. Its IUPAC name is N-ethyl-2-[ethyl-[[4-hydroxy-3-(trifluoromethyl)phenyl]methyl]amino]acetamide.

Molecular Properties

Compound NameN-ethyl-2-[ethyl-[[4-hydroxy-3-(trifluoromethyl)phenyl]methyl]amino]acetamide
PubChem CID82957049
Molecular FormulaC14H19F3N2O2
Molecular Weight304.31 g/mol
Exact Mass304.14
IUPAC NameN-ethyl-2-[ethyl-[[4-hydroxy-3-(trifluoromethyl)phenyl]methyl]amino]acetamide
SMILESCCNC(=O)CN(CC)Cc1ccc(O)c(C(F)(F)F)c1
InChIInChI=1S/C14H19F3N2O2/c1-3-18-13(21)9-19(4-2)8-10-5-6-12(20)11(7-10)14(15,16)17/h5-7,20H,3-4,8-9H2,1-2H3,(H,18,21)
InChIKeyGGAVJTGPMQNPGH-UHFFFAOYSA-N
XLogP2.37
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.31
LogP ≤ 52.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-ethyl-2-[ethyl-[[4-hydroxy-3-(trifluoromethyl)phenyl]methyl]amino]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[(3,4-dimethoxyphenyl)methyl-ethylamino]-N-ethylacetamide
CID 32661950
2-[(4-bromophenyl)methyl-ethylamino]-N-ethylacetamide
CID 54939808
4-[[ethyl(methyl)amino]methyl]-2-(trifluoromethyl)phenol
CID 82977713
2-[(5-chloro-2-hydroxyphenyl)methyl-ethylamino]-N-ethylacetamide
CID 82986726
ethane;4-ethyl-2-(trifluoromethyl)phenol
CID 143680036
2-[(2-amino-4-pyridinyl)methyl-ethylamino]-N-ethylacetamide
CID 62465226
2-[ethyl-[[4-(trifluoromethyl)phenyl]methyl]amino]-N-[2-(trifluoromethyl)phenyl]acetamide
CID 24506960
4-[[butan-2-yl(methyl)amino]methyl]-2-(trifluoromethyl)phenol
CID 82976724
2-[[2-(3,4-dihydroxyphenyl)-2-oxoethyl]-ethylamino]-N-ethylacetamide
CID 62029540
2-[ethyl-[(4-propan-2-ylphenyl)methyl]amino]-N-[2-(trifluoromethyl)phenyl]acetamide
CID 26514549
N-ethyl-2-[ethyl-[(2-hydroxy-4-methoxyphenyl)methyl]amino]acetamide
CID 82986658
2-[(3-amino-4-hydroxyphenyl)methyl-ethylamino]-N-propan-2-ylacetamide
CID 54985803

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[ethyl-[[4-hydroxy-3-(trifluoromethyl)phenyl]methyl]amino]acetamide?
The IUPAC name of N-ethyl-2-[ethyl-[[4-hydroxy-3-(trifluoromethyl)phenyl]methyl]amino]acetamide (CID 82957049) is N-ethyl-2-[ethyl-[[4-hydroxy-3-(trifluoromethyl)phenyl]methyl]amino]acetamide.
What is the SMILES notation for N-ethyl-2-[ethyl-[[4-hydroxy-3-(trifluoromethyl)phenyl]methyl]amino]acetamide?
The canonical SMILES for N-ethyl-2-[ethyl-[[4-hydroxy-3-(trifluoromethyl)phenyl]methyl]amino]acetamide is CCNC(=O)CN(CC)Cc1ccc(O)c(C(F)(F)F)c1.
What is the InChIKey of N-ethyl-2-[ethyl-[[4-hydroxy-3-(trifluoromethyl)phenyl]methyl]amino]acetamide?
The InChIKey is GGAVJTGPMQNPGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19F3N2O2/c1-3-18-13(21)9-19(4-2)8-10-5-6-12(20)11(7-10)14(15,16)17/h5-7,20H,3-4,8-9H2,1-2H3,(H,18,21).
What are the key properties of N-ethyl-2-[ethyl-[[4-hydroxy-3-(trifluoromethyl)phenyl]methyl]amino]acetamide?
N-ethyl-2-[ethyl-[[4-hydroxy-3-(trifluoromethyl)phenyl]methyl]amino]acetamide has a molecular weight of 304.31 g/mol, XLogP of 2.37, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[ethyl-[[4-hydroxy-3-(trifluoromethyl)phenyl]methyl]amino]acetamide is sourced from PubChem (CID 82957049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).