N-(2,6-difluorophenyl)-2-[methyl(thiophen-2-ylmethyl)amino]acetamide

C14H14F2N2OS — CID 8965451

IUPACN-(2,6-difluorophenyl)-2-[methyl(thiophen-2-ylmethyl)amino]acetamide
SMILESCN(CC(=O)Nc1c(F)cccc1F)Cc1cccs1
InChIInChI=1S/C14H14F2N2OS/c1-18(8-10-4-3-7-20-10)9-13(19)17-14-11(15)5-2-6-12(14)16/h2-7H,8-9H2,1H3,(H,17,19)
InChIKeyYYADTIRYODEDTF-UHFFFAOYSA-N
MW296.34 g/mol
LogP3.10
Rot. Bonds5

About N-(2,6-difluorophenyl)-2-[methyl(thiophen-2-ylmethyl)amino]acetamide

N-(2,6-difluorophenyl)-2-[methyl(thiophen-2-ylmethyl)amino]acetamide (PubChem CID 8965451) has the molecular formula C14H14F2N2OS and a molecular weight of 296.34 g/mol. Its IUPAC name is N-(2,6-difluorophenyl)-2-[methyl(thiophen-2-ylmethyl)amino]acetamide.

Molecular Properties

Compound NameN-(2,6-difluorophenyl)-2-[methyl(thiophen-2-ylmethyl)amino]acetamide
PubChem CID8965451
Molecular FormulaC14H14F2N2OS
Molecular Weight296.34 g/mol
Exact Mass296.08
IUPAC NameN-(2,6-difluorophenyl)-2-[methyl(thiophen-2-ylmethyl)amino]acetamide
SMILESCN(CC(=O)Nc1c(F)cccc1F)Cc1cccs1
InChIInChI=1S/C14H14F2N2OS/c1-18(8-10-4-3-7-20-10)9-13(19)17-14-11(15)5-2-6-12(14)16/h2-7H,8-9H2,1H3,(H,17,19)
InChIKeyYYADTIRYODEDTF-UHFFFAOYSA-N
XLogP3.10
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.34
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2,6-difluorophenyl)-2-[methyl(thiophen-2-ylmethyl)amino]acetamide?
The IUPAC name of N-(2,6-difluorophenyl)-2-[methyl(thiophen-2-ylmethyl)amino]acetamide (CID 8965451) is N-(2,6-difluorophenyl)-2-[methyl(thiophen-2-ylmethyl)amino]acetamide.
What is the SMILES notation for N-(2,6-difluorophenyl)-2-[methyl(thiophen-2-ylmethyl)amino]acetamide?
The canonical SMILES for N-(2,6-difluorophenyl)-2-[methyl(thiophen-2-ylmethyl)amino]acetamide is CN(CC(=O)Nc1c(F)cccc1F)Cc1cccs1.
What is the InChIKey of N-(2,6-difluorophenyl)-2-[methyl(thiophen-2-ylmethyl)amino]acetamide?
The InChIKey is YYADTIRYODEDTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14F2N2OS/c1-18(8-10-4-3-7-20-10)9-13(19)17-14-11(15)5-2-6-12(14)16/h2-7H,8-9H2,1H3,(H,17,19).
What are the key properties of N-(2,6-difluorophenyl)-2-[methyl(thiophen-2-ylmethyl)amino]acetamide?
N-(2,6-difluorophenyl)-2-[methyl(thiophen-2-ylmethyl)amino]acetamide has a molecular weight of 296.34 g/mol, XLogP of 3.10, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-difluorophenyl)-2-[methyl(thiophen-2-ylmethyl)amino]acetamide is sourced from PubChem (CID 8965451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).