N-methyl-5-(2-methylbutan-2-yl)-1,3-thiazole-2-carboxamide

C10H16N2OS — CID 176964958

IUPACN-methyl-5-(2-methylbutan-2-yl)-1,3-thiazole-2-carboxamide
SMILESCCC(C)(C)c1cnc(C(=O)NC)s1
InChIInChI=1S/C10H16N2OS/c1-5-10(2,3)7-6-12-9(14-7)8(13)11-4/h6H,5H2,1-4H3,(H,11,13)
InChIKeyGFSASYQWZRVBQR-UHFFFAOYSA-N
MW212.32 g/mol
LogP2.19
Rot. Bonds3

About N-methyl-5-(2-methylbutan-2-yl)-1,3-thiazole-2-carboxamide

N-methyl-5-(2-methylbutan-2-yl)-1,3-thiazole-2-carboxamide (PubChem CID 176964958) has the molecular formula C10H16N2OS and a molecular weight of 212.32 g/mol. Its IUPAC name is N-methyl-5-(2-methylbutan-2-yl)-1,3-thiazole-2-carboxamide.

Molecular Properties

Compound NameN-methyl-5-(2-methylbutan-2-yl)-1,3-thiazole-2-carboxamide
PubChem CID176964958
Molecular FormulaC10H16N2OS
Molecular Weight212.32 g/mol
Exact Mass212.10
IUPAC NameN-methyl-5-(2-methylbutan-2-yl)-1,3-thiazole-2-carboxamide
SMILESCCC(C)(C)c1cnc(C(=O)NC)s1
InChIInChI=1S/C10H16N2OS/c1-5-10(2,3)7-6-12-9(14-7)8(13)11-4/h6H,5H2,1-4H3,(H,11,13)
InChIKeyGFSASYQWZRVBQR-UHFFFAOYSA-N
XLogP2.19
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.32
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-4-(2-methylbutan-2-yl)pyridine-2-carboxamide
CID 129189538
N-methyl-5-propan-2-yl-1,3-thiazole-2-carboxamide
CID 166021780
N-methyl-5-(2,4,4-trimethylhexan-2-yl)pyrazine-2-carboxamide
CID 167229251
N,2-dimethyl-5-(2-methylbutan-2-yl)furan-3-carboxamide;molecular hydrogen
CID 170574744
2-[4-fluoro-2,6-di(propan-2-yl)phenyl]-N-[[5-(2-methylbutan-2-yl)-1,3-thiazol-2-yl]sulfonyl]acetamide
CID 159092232
4-[(2-amino-2-ethylbutyl)amino]-N-methylpyridine-2-carboxamide
CID 113283242
N-methyl-[1,3]thiazolo[5,4-d]pyrimidine-2-carboxamide
CID 144771453
2-ethylsulfinyl-N-methyl-1,3-thiazole-5-carboxamide
CID 21391947
[5-(2-hydroxypropan-2-yl)-1,3-thiazol-2-yl]carbamic acid
CID 151016388
5-(ethylamino)-N-methylpyridine-2-carboxamide
CID 104639889
2-ethyl-N-(2-methylbutan-2-yl)-1,3-thiazole-5-carboxamide
CID 48571573
5-[4-[(1S)-3-tert-butylcyclopentyl]piperazin-1-yl]-N-methyl-1,3-thiazole-2-carboxamide
CID 176965172

Frequently Asked Questions

What is the IUPAC name of N-methyl-5-(2-methylbutan-2-yl)-1,3-thiazole-2-carboxamide?
The IUPAC name of N-methyl-5-(2-methylbutan-2-yl)-1,3-thiazole-2-carboxamide (CID 176964958) is N-methyl-5-(2-methylbutan-2-yl)-1,3-thiazole-2-carboxamide.
What is the SMILES notation for N-methyl-5-(2-methylbutan-2-yl)-1,3-thiazole-2-carboxamide?
The canonical SMILES for N-methyl-5-(2-methylbutan-2-yl)-1,3-thiazole-2-carboxamide is CCC(C)(C)c1cnc(C(=O)NC)s1.
What is the InChIKey of N-methyl-5-(2-methylbutan-2-yl)-1,3-thiazole-2-carboxamide?
The InChIKey is GFSASYQWZRVBQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2OS/c1-5-10(2,3)7-6-12-9(14-7)8(13)11-4/h6H,5H2,1-4H3,(H,11,13).
What are the key properties of N-methyl-5-(2-methylbutan-2-yl)-1,3-thiazole-2-carboxamide?
N-methyl-5-(2-methylbutan-2-yl)-1,3-thiazole-2-carboxamide has a molecular weight of 212.32 g/mol, XLogP of 2.19, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-5-(2-methylbutan-2-yl)-1,3-thiazole-2-carboxamide is sourced from PubChem (CID 176964958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).