4-tert-butyl-N,N-diethyl-1,3-thiazol-2-amine

C11H20N2S — CID 12787021

IUPAC4-tert-butyl-N,N-diethyl-1,3-thiazol-2-amine
SMILESCCN(CC)c1nc(C(C)(C)C)cs1
InChIInChI=1S/C11H20N2S/c1-6-13(7-2)10-12-9(8-14-10)11(3,4)5/h8H,6-7H2,1-5H3
InChIKeyIRHCMXGATXKLMG-UHFFFAOYSA-N
MW212.36 g/mol
LogP3.29
Rot. Bonds3

About 4-tert-butyl-N,N-diethyl-1,3-thiazol-2-amine

4-tert-butyl-N,N-diethyl-1,3-thiazol-2-amine (PubChem CID 12787021) has the molecular formula C11H20N2S and a molecular weight of 212.36 g/mol. Its IUPAC name is 4-tert-butyl-N,N-diethyl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-tert-butyl-N,N-diethyl-1,3-thiazol-2-amine
PubChem CID12787021
Molecular FormulaC11H20N2S
Molecular Weight212.36 g/mol
Exact Mass212.13
IUPAC Name4-tert-butyl-N,N-diethyl-1,3-thiazol-2-amine
SMILESCCN(CC)c1nc(C(C)(C)C)cs1
InChIInChI=1S/C11H20N2S/c1-6-13(7-2)10-12-9(8-14-10)11(3,4)5/h8H,6-7H2,1-5H3
InChIKeyIRHCMXGATXKLMG-UHFFFAOYSA-N
XLogP3.29
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.36
LogP ≤ 53.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-tert-Butyl-1,3-thiazol-2-amine
CID 2734202
4-(4-Tert-butyl-1,3-thiazol-2-yl)morpholine
CID 1490753
Tebatizole
CID 3085056
3-[(4-Tert-butyl-1,3-thiazol-2-yl)(2-cyanoethyl)amino]propanenitrile
CID 3244892
4-Methyl-2-(pyrrolidin-1-yl)-1,3-thiazole
CID 2513439
1,4-Dihydro-4,4-dimethyl-1-(4-methyl-2-thiazolyl) pyridine
CID 44313067
4-tert-butyl-N-methyl-1,3-thiazol-2-amine
CID 4175801
4-tert-butyl-N-(3,4-dihydro-2H-pyrrol-5-yl)-1,3-thiazol-2-amine
CID 2123303
N,N,4-triethyl-1,3-thiazol-2-amine
CID 12787020
4-tert-Butyl-N,N-dimethyl-1,3-thiazol-2-amine
CID 12910384
4-Ethyl-2-(3-fluoropiperidin-1-yl)-1,3-thiazole
CID 70954946
2-(3,3-Difluoroazetidin-1-yl)-4-ethyl-1,3-thiazole
CID 70954955

Frequently Asked Questions

What is the IUPAC name of 4-tert-butyl-N,N-diethyl-1,3-thiazol-2-amine?
The IUPAC name of 4-tert-butyl-N,N-diethyl-1,3-thiazol-2-amine (CID 12787021) is 4-tert-butyl-N,N-diethyl-1,3-thiazol-2-amine.
What is the SMILES notation for 4-tert-butyl-N,N-diethyl-1,3-thiazol-2-amine?
The canonical SMILES for 4-tert-butyl-N,N-diethyl-1,3-thiazol-2-amine is CCN(CC)c1nc(C(C)(C)C)cs1.
What is the InChIKey of 4-tert-butyl-N,N-diethyl-1,3-thiazol-2-amine?
The InChIKey is IRHCMXGATXKLMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2S/c1-6-13(7-2)10-12-9(8-14-10)11(3,4)5/h8H,6-7H2,1-5H3.
What are the key properties of 4-tert-butyl-N,N-diethyl-1,3-thiazol-2-amine?
4-tert-butyl-N,N-diethyl-1,3-thiazol-2-amine has a molecular weight of 212.36 g/mol, XLogP of 3.29, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butyl-N,N-diethyl-1,3-thiazol-2-amine is sourced from PubChem (CID 12787021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).