2,2-difluoro-N-(5-methyl-1,3-thiazol-2-yl)cyclopropane-1-carboxamide

C8H8F2N2OS — CID 126792132

IUPAC2,2-difluoro-N-(5-methyl-1,3-thiazol-2-yl)cyclopropane-1-carboxamide
SMILESCc1cnc(NC(=O)C2CC2(F)F)s1
InChIInChI=1S/C8H8F2N2OS/c1-4-3-11-7(14-4)12-6(13)5-2-8(5,9)10/h3,5H,2H2,1H3,(H,11,12,13)
InChIKeyGCNCPXZTOQGWNB-UHFFFAOYSA-N
MW218.23 g/mol
LogP2.05
Rot. Bonds2

About 2,2-difluoro-N-(5-methyl-1,3-thiazol-2-yl)cyclopropane-1-carboxamide

2,2-difluoro-N-(5-methyl-1,3-thiazol-2-yl)cyclopropane-1-carboxamide (PubChem CID 126792132) has the molecular formula C8H8F2N2OS and a molecular weight of 218.23 g/mol. Its IUPAC name is 2,2-difluoro-N-(5-methyl-1,3-thiazol-2-yl)cyclopropane-1-carboxamide.

Molecular Properties

Compound Name2,2-difluoro-N-(5-methyl-1,3-thiazol-2-yl)cyclopropane-1-carboxamide
PubChem CID126792132
Molecular FormulaC8H8F2N2OS
Molecular Weight218.23 g/mol
Exact Mass218.03
IUPAC Name2,2-difluoro-N-(5-methyl-1,3-thiazol-2-yl)cyclopropane-1-carboxamide
SMILESCc1cnc(NC(=O)C2CC2(F)F)s1
InChIInChI=1S/C8H8F2N2OS/c1-4-3-11-7(14-4)12-6(13)5-2-8(5,9)10/h3,5H,2H2,1H3,(H,11,12,13)
InChIKeyGCNCPXZTOQGWNB-UHFFFAOYSA-N
XLogP2.05
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.23
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-Isopropyl-thiazol-2-yl)-isobutyramide
CID 44396116
N-(5-methyl-1,3-thiazol-2-yl)cyclopentanecarboxamide
CID 2579380
2-Acetamido-5-methylthiazole
CID 298507
2,2-dibromo-1-methyl-N-(5-methyl-1,3-thiazol-2-yl)cyclopropanecarboxamide
CID 4069823
N-(5-methyl-1,3-thiazol-2-yl)-1-(2,2,2-trifluoroethyl)piperidine-4-carboxamide
CID 45824857
2-(3-methylbutylamino)-N-(5-methyl-1,3-thiazol-2-yl)acetamide
CID 4334665
N-(5-methyl-1,3-thiazol-2-yl)piperidine-4-carboxamide
CID 18072746
N-(5-cyanothiazol-2-yl)cyclopropanecarboxamide
CID 52417473
N-[2,2,2-trifluoro-1-[(5-methyl-1,3-thiazol-2-yl)amino]-1-(trifluoromethyl)ethyl]propanamide
CID 1208101
3-methyl-N-[2,2,2-trifluoro-1-[(5-methyl-1,3-thiazol-2-yl)amino]-1-(trifluoromethyl)ethyl]butanamide
CID 1717062
Methyl 3,3,3-trifluoro-2-(3-methylbutanoylamino)-2-[(5-methyl-1,3-thiazol-2-yl)amino]propanoate
CID 4099293
2,2,3,3,3-pentafluoro-N-(5-methyl-1,3-thiazol-2-yl)propanamide
CID 17386520

Frequently Asked Questions

What is the IUPAC name of 2,2-difluoro-N-(5-methyl-1,3-thiazol-2-yl)cyclopropane-1-carboxamide?
The IUPAC name of 2,2-difluoro-N-(5-methyl-1,3-thiazol-2-yl)cyclopropane-1-carboxamide (CID 126792132) is 2,2-difluoro-N-(5-methyl-1,3-thiazol-2-yl)cyclopropane-1-carboxamide.
What is the SMILES notation for 2,2-difluoro-N-(5-methyl-1,3-thiazol-2-yl)cyclopropane-1-carboxamide?
The canonical SMILES for 2,2-difluoro-N-(5-methyl-1,3-thiazol-2-yl)cyclopropane-1-carboxamide is Cc1cnc(NC(=O)C2CC2(F)F)s1.
What is the InChIKey of 2,2-difluoro-N-(5-methyl-1,3-thiazol-2-yl)cyclopropane-1-carboxamide?
The InChIKey is GCNCPXZTOQGWNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8F2N2OS/c1-4-3-11-7(14-4)12-6(13)5-2-8(5,9)10/h3,5H,2H2,1H3,(H,11,12,13).
What are the key properties of 2,2-difluoro-N-(5-methyl-1,3-thiazol-2-yl)cyclopropane-1-carboxamide?
2,2-difluoro-N-(5-methyl-1,3-thiazol-2-yl)cyclopropane-1-carboxamide has a molecular weight of 218.23 g/mol, XLogP of 2.05, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoro-N-(5-methyl-1,3-thiazol-2-yl)cyclopropane-1-carboxamide is sourced from PubChem (CID 126792132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).