N-(2,4-dimethoxyphenyl)-4,4-dimethyl-5H-1,3-thiazol-2-amine

C13H18N2O2S — CID 43382052

IUPACN-(2,4-dimethoxyphenyl)-4,4-dimethyl-5H-1,3-thiazol-2-amine
SMILESCOc1ccc(NC2=NC(C)(C)CS2)c(OC)c1
InChIInChI=1S/C13H18N2O2S/c1-13(2)8-18-12(15-13)14-10-6-5-9(16-3)7-11(10)17-4/h5-7H,8H2,1-4H3,(H,14,15)
InChIKeyGVXSIADIPGVGOA-UHFFFAOYSA-N
MW266.37 g/mol
LogP3.00
Rot. Bonds3

About N-(2,4-dimethoxyphenyl)-4,4-dimethyl-5H-1,3-thiazol-2-amine

N-(2,4-dimethoxyphenyl)-4,4-dimethyl-5H-1,3-thiazol-2-amine (PubChem CID 43382052) has the molecular formula C13H18N2O2S and a molecular weight of 266.37 g/mol. Its IUPAC name is N-(2,4-dimethoxyphenyl)-4,4-dimethyl-5H-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-(2,4-dimethoxyphenyl)-4,4-dimethyl-5H-1,3-thiazol-2-amine
PubChem CID43382052
Molecular FormulaC13H18N2O2S
Molecular Weight266.37 g/mol
Exact Mass266.11
IUPAC NameN-(2,4-dimethoxyphenyl)-4,4-dimethyl-5H-1,3-thiazol-2-amine
SMILESCOc1ccc(NC2=NC(C)(C)CS2)c(OC)c1
InChIInChI=1S/C13H18N2O2S/c1-13(2)8-18-12(15-13)14-10-6-5-9(16-3)7-11(10)17-4/h5-7H,8H2,1-4H3,(H,14,15)
InChIKeyGVXSIADIPGVGOA-UHFFFAOYSA-N
XLogP3.00
TPSA42.85 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.37
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2,4-dimethoxyphenyl)-3-thia-1-azaspiro[4.4]non-1-en-2-amine
CID 62522943
N-(2,5-diethoxyphenyl)-4,4-dimethyl-5H-1,3-thiazol-2-amine
CID 43439757
N-(2,4-dimethoxyphenyl)-4a,5,6,7,8,8a-hexahydro-4H-3,1-benzothiazin-2-amine
CID 106362621
N-(4-fluoro-2-methoxyphenyl)-3-thia-1-azaspiro[4.4]non-1-en-2-amine
CID 62516977
2,4-dimethoxy-N-methylaniline;ethane
CID 143206191
N-(4-fluoro-2-methoxyphenyl)-8-oxa-3-thia-1-azaspiro[4.5]dec-1-en-2-amine
CID 106298265
N-(2-chloro-5-methylphenyl)-4,4-dimethyl-5H-1,3-thiazol-2-amine
CID 107637550
4-N,6-N-bis(2,4-dimethoxyphenyl)pyrimidine-4,5,6-triamine
CID 19142820
1-[[4-(2,4-dimethoxyanilino)-1,3-thiazet-2-ylidene]amino]propan-2-one
CID 3435999
N-(2,4-dimethoxyphenyl)-2,2-dimethyl-1,3-dioxan-5-amine
CID 106657987
5-(2,4-dimethoxyanilino)-3-methyl-1,2-thiazole-4-carboxylic acid
CID 79402513
1-(4,5-dihydro-1,3-thiazol-2-yl)-3-(2,4-dimethoxyphenyl)urea
CID 5146476

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethoxyphenyl)-4,4-dimethyl-5H-1,3-thiazol-2-amine?
The IUPAC name of N-(2,4-dimethoxyphenyl)-4,4-dimethyl-5H-1,3-thiazol-2-amine (CID 43382052) is N-(2,4-dimethoxyphenyl)-4,4-dimethyl-5H-1,3-thiazol-2-amine.
What is the SMILES notation for N-(2,4-dimethoxyphenyl)-4,4-dimethyl-5H-1,3-thiazol-2-amine?
The canonical SMILES for N-(2,4-dimethoxyphenyl)-4,4-dimethyl-5H-1,3-thiazol-2-amine is COc1ccc(NC2=NC(C)(C)CS2)c(OC)c1.
What is the InChIKey of N-(2,4-dimethoxyphenyl)-4,4-dimethyl-5H-1,3-thiazol-2-amine?
The InChIKey is GVXSIADIPGVGOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O2S/c1-13(2)8-18-12(15-13)14-10-6-5-9(16-3)7-11(10)17-4/h5-7H,8H2,1-4H3,(H,14,15).
What are the key properties of N-(2,4-dimethoxyphenyl)-4,4-dimethyl-5H-1,3-thiazol-2-amine?
N-(2,4-dimethoxyphenyl)-4,4-dimethyl-5H-1,3-thiazol-2-amine has a molecular weight of 266.37 g/mol, XLogP of 3.00, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethoxyphenyl)-4,4-dimethyl-5H-1,3-thiazol-2-amine is sourced from PubChem (CID 43382052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).