2,2-difluoro-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]acetamide

C8H10F2N2OS — CID 103515099

IUPAC2,2-difluoro-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]acetamide
SMILESCc1ncc(CN(C)C(=O)C(F)F)s1
InChIInChI=1S/C8H10F2N2OS/c1-5-11-3-6(14-5)4-12(2)8(13)7(9)10/h3,7H,4H2,1-2H3
InChIKeyGRNFMCBBKDBTGU-UHFFFAOYSA-N
MW220.24 g/mol
LogP1.68
Rot. Bonds3

About 2,2-difluoro-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]acetamide

2,2-difluoro-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]acetamide (PubChem CID 103515099) has the molecular formula C8H10F2N2OS and a molecular weight of 220.24 g/mol. Its IUPAC name is 2,2-difluoro-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]acetamide.

Molecular Properties

Compound Name2,2-difluoro-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]acetamide
PubChem CID103515099
Molecular FormulaC8H10F2N2OS
Molecular Weight220.24 g/mol
Exact Mass220.05
IUPAC Name2,2-difluoro-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]acetamide
SMILESCc1ncc(CN(C)C(=O)C(F)F)s1
InChIInChI=1S/C8H10F2N2OS/c1-5-11-3-6(14-5)4-12(2)8(13)7(9)10/h3,7H,4H2,1-2H3
InChIKeyGRNFMCBBKDBTGU-UHFFFAOYSA-N
XLogP1.68
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.24
LogP ≤ 51.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,2-difluoro-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]acetamide?
The IUPAC name of 2,2-difluoro-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]acetamide (CID 103515099) is 2,2-difluoro-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]acetamide.
What is the SMILES notation for 2,2-difluoro-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]acetamide?
The canonical SMILES for 2,2-difluoro-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]acetamide is Cc1ncc(CN(C)C(=O)C(F)F)s1.
What is the InChIKey of 2,2-difluoro-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]acetamide?
The InChIKey is GRNFMCBBKDBTGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10F2N2OS/c1-5-11-3-6(14-5)4-12(2)8(13)7(9)10/h3,7H,4H2,1-2H3.
What are the key properties of 2,2-difluoro-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]acetamide?
2,2-difluoro-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]acetamide has a molecular weight of 220.24 g/mol, XLogP of 1.68, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoro-N-methyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]acetamide is sourced from PubChem (CID 103515099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).