N-(2,3-dihydro-1H-inden-5-yl)-4-ethyl-4-methyl-5H-1,3-thiazol-2-amine

C15H20N2S — CID 64549228

IUPACN-(2,3-dihydro-1H-inden-5-yl)-4-ethyl-4-methyl-5H-1,3-thiazol-2-amine
SMILESCCC1(C)CSC(Nc2ccc3c(c2)CCC3)=N1
InChIInChI=1S/C15H20N2S/c1-3-15(2)10-18-14(17-15)16-13-8-7-11-5-4-6-12(11)9-13/h7-9H,3-6,10H2,1-2H3,(H,16,17)
InChIKeyVATIUPZCTQMLMW-UHFFFAOYSA-N
MW260.41 g/mol
LogP3.86
Rot. Bonds2

About N-(2,3-dihydro-1H-inden-5-yl)-4-ethyl-4-methyl-5H-1,3-thiazol-2-amine

N-(2,3-dihydro-1H-inden-5-yl)-4-ethyl-4-methyl-5H-1,3-thiazol-2-amine (PubChem CID 64549228) has the molecular formula C15H20N2S and a molecular weight of 260.41 g/mol. Its IUPAC name is N-(2,3-dihydro-1H-inden-5-yl)-4-ethyl-4-methyl-5H-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-(2,3-dihydro-1H-inden-5-yl)-4-ethyl-4-methyl-5H-1,3-thiazol-2-amine
PubChem CID64549228
Molecular FormulaC15H20N2S
Molecular Weight260.41 g/mol
Exact Mass260.13
IUPAC NameN-(2,3-dihydro-1H-inden-5-yl)-4-ethyl-4-methyl-5H-1,3-thiazol-2-amine
SMILESCCC1(C)CSC(Nc2ccc3c(c2)CCC3)=N1
InChIInChI=1S/C15H20N2S/c1-3-15(2)10-18-14(17-15)16-13-8-7-11-5-4-6-12(11)9-13/h7-9H,3-6,10H2,1-2H3,(H,16,17)
InChIKeyVATIUPZCTQMLMW-UHFFFAOYSA-N
XLogP3.86
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.41
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-ethyl-N-(3-iodophenyl)-4-methyl-5H-1,3-thiazol-2-amine
CID 64556048
4-ethyl-4-methyl-N-(4-pyrrolidin-1-ylphenyl)-5H-1,3-thiazol-2-amine
CID 64551733
N-(4-chloro-3-methoxyphenyl)-4-ethyl-4-methyl-5H-1,3-thiazol-2-amine
CID 107622339
3-[(4-ethyl-4-methyl-5H-1,3-thiazol-2-yl)amino]benzenesulfonamide
CID 64549640
N-(1,3-dihydro-2-benzofuran-5-yl)-4,4-dimethyl-5H-1,3-thiazol-2-amine
CID 114263140
N-(2,3-dihydro-1H-inden-5-yl)-4-methyl-4,5-dihydro-1,3-thiazol-2-amine
CID 43439861
N-(2,3-dihydro-1H-inden-5-yl)-4-(2-methylpropyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 61245801
N-(2,3-dihydro-1H-inden-5-yl)-4-propan-2-yl-4,5-dihydro-1,3-thiazol-2-amine
CID 114009766
4-ethyl-4-methyl-N-phenyl-5,6-dihydro-1,3-thiazin-2-amine
CID 106164620
N-(4-bromo-2,6-dichlorophenyl)-4-ethyl-4-methyl-5H-1,3-thiazol-2-amine
CID 64558420
N-(2,5-diethoxyphenyl)-4-ethyl-4-methyl-5H-1,3-thiazol-2-amine
CID 64550265
5-chloro-N-(4-ethyl-4-methyl-5H-1,3-thiazol-2-yl)-2,1,3-benzothiadiazol-4-amine
CID 65475691

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1H-inden-5-yl)-4-ethyl-4-methyl-5H-1,3-thiazol-2-amine?
The IUPAC name of N-(2,3-dihydro-1H-inden-5-yl)-4-ethyl-4-methyl-5H-1,3-thiazol-2-amine (CID 64549228) is N-(2,3-dihydro-1H-inden-5-yl)-4-ethyl-4-methyl-5H-1,3-thiazol-2-amine.
What is the SMILES notation for N-(2,3-dihydro-1H-inden-5-yl)-4-ethyl-4-methyl-5H-1,3-thiazol-2-amine?
The canonical SMILES for N-(2,3-dihydro-1H-inden-5-yl)-4-ethyl-4-methyl-5H-1,3-thiazol-2-amine is CCC1(C)CSC(Nc2ccc3c(c2)CCC3)=N1.
What is the InChIKey of N-(2,3-dihydro-1H-inden-5-yl)-4-ethyl-4-methyl-5H-1,3-thiazol-2-amine?
The InChIKey is VATIUPZCTQMLMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2S/c1-3-15(2)10-18-14(17-15)16-13-8-7-11-5-4-6-12(11)9-13/h7-9H,3-6,10H2,1-2H3,(H,16,17).
What are the key properties of N-(2,3-dihydro-1H-inden-5-yl)-4-ethyl-4-methyl-5H-1,3-thiazol-2-amine?
N-(2,3-dihydro-1H-inden-5-yl)-4-ethyl-4-methyl-5H-1,3-thiazol-2-amine has a molecular weight of 260.41 g/mol, XLogP of 3.86, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-1H-inden-5-yl)-4-ethyl-4-methyl-5H-1,3-thiazol-2-amine is sourced from PubChem (CID 64549228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).