N-ethyl-2-[(2-fluorophenyl)methyl-methylamino]acetamide

C12H17FN2O — CID 78791355

IUPACN-ethyl-2-[(2-fluorophenyl)methyl-methylamino]acetamide
SMILESCCNC(=O)CN(C)Cc1ccccc1F
InChIInChI=1S/C12H17FN2O/c1-3-14-12(16)9-15(2)8-10-6-4-5-7-11(10)13/h4-7H,3,8-9H2,1-2H3,(H,14,16)
InChIKeyJQEWLCJJFVJFJC-UHFFFAOYSA-N
MW224.28 g/mol
LogP1.39
Rot. Bonds5

About N-ethyl-2-[(2-fluorophenyl)methyl-methylamino]acetamide

N-ethyl-2-[(2-fluorophenyl)methyl-methylamino]acetamide (PubChem CID 78791355) has the molecular formula C12H17FN2O and a molecular weight of 224.28 g/mol. Its IUPAC name is N-ethyl-2-[(2-fluorophenyl)methyl-methylamino]acetamide.

Molecular Properties

Compound NameN-ethyl-2-[(2-fluorophenyl)methyl-methylamino]acetamide
PubChem CID78791355
Molecular FormulaC12H17FN2O
Molecular Weight224.28 g/mol
Exact Mass224.13
IUPAC NameN-ethyl-2-[(2-fluorophenyl)methyl-methylamino]acetamide
SMILESCCNC(=O)CN(C)Cc1ccccc1F
InChIInChI=1S/C12H17FN2O/c1-3-14-12(16)9-15(2)8-10-6-4-5-7-11(10)13/h4-7H,3,8-9H2,1-2H3,(H,14,16)
InChIKeyJQEWLCJJFVJFJC-UHFFFAOYSA-N
XLogP1.39
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.28
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-ethyl-2-[(2-fluorophenyl)methyl-methylamino]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

N-ethyl-2-[(3-fluoro-2-hydroxyphenyl)methyl-methylamino]acetamide
CID 112616212
N-ethyl-2-[[3-(2-fluorophenyl)-2-oxopropyl]-methylamino]acetamide
CID 62036688
2-[(2-aminophenyl)methyl-methylamino]-N-ethylacetamide
CID 43458547
N-(2-cyanoethyl)-2-[(2-fluorophenyl)methyl-methylamino]acetamide
CID 18124298
2-[(2-fluorophenyl)methyl-methylamino]-N-[(3-methylthiophen-2-yl)methyl]acetamide
CID 87013271
2-[[2-[(2-fluorophenyl)methyl-methylamino]acetyl]amino]-N-(2,3,4-trifluorophenyl)acetamide
CID 9034646
2-[[3-(aminomethyl)-4-fluorophenyl]methyl-methylamino]-N-ethylacetamide
CID 114011952
N-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]-2-[(2-fluorophenyl)methyl-methylamino]acetamide
CID 91787380
N-(2-ethyl-6-methylphenyl)-2-[(2-fluorophenyl)methyl-methylamino]acetamide;oxalic acid
CID 15945235
2-[(2-fluorophenyl)methyl-methylamino]-N-(2-methyl-1-phenylpropyl)acetamide
CID 24566119
2-[(2-fluorophenyl)methyl-methylamino]-N-(2-methoxyphenyl)acetamide
CID 8005528
2-[(3,5-difluoro-4-hydroxyphenyl)methyl-methylamino]-N-ethylacetamide
CID 82978666

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[(2-fluorophenyl)methyl-methylamino]acetamide?
The IUPAC name of N-ethyl-2-[(2-fluorophenyl)methyl-methylamino]acetamide (CID 78791355) is N-ethyl-2-[(2-fluorophenyl)methyl-methylamino]acetamide.
What is the SMILES notation for N-ethyl-2-[(2-fluorophenyl)methyl-methylamino]acetamide?
The canonical SMILES for N-ethyl-2-[(2-fluorophenyl)methyl-methylamino]acetamide is CCNC(=O)CN(C)Cc1ccccc1F.
What is the InChIKey of N-ethyl-2-[(2-fluorophenyl)methyl-methylamino]acetamide?
The InChIKey is JQEWLCJJFVJFJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17FN2O/c1-3-14-12(16)9-15(2)8-10-6-4-5-7-11(10)13/h4-7H,3,8-9H2,1-2H3,(H,14,16).
What are the key properties of N-ethyl-2-[(2-fluorophenyl)methyl-methylamino]acetamide?
N-ethyl-2-[(2-fluorophenyl)methyl-methylamino]acetamide has a molecular weight of 224.28 g/mol, XLogP of 1.39, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[(2-fluorophenyl)methyl-methylamino]acetamide is sourced from PubChem (CID 78791355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).