N-ethyl-1-(4-ethyl-1,3-thiazol-2-yl)butan-2-amine

C11H20N2S — CID 63202023

IUPACN-ethyl-1-(4-ethyl-1,3-thiazol-2-yl)butan-2-amine
SMILESCCNC(CC)Cc1nc(CC)cs1
InChIInChI=1S/C11H20N2S/c1-4-9(12-6-3)7-11-13-10(5-2)8-14-11/h8-9,12H,4-7H2,1-3H3
InChIKeySFNMNQHIILWSNU-UHFFFAOYSA-N
MW212.36 g/mol
LogP2.64
Rot. Bonds6

About N-ethyl-1-(4-ethyl-1,3-thiazol-2-yl)butan-2-amine

N-ethyl-1-(4-ethyl-1,3-thiazol-2-yl)butan-2-amine (PubChem CID 63202023) has the molecular formula C11H20N2S and a molecular weight of 212.36 g/mol. Its IUPAC name is N-ethyl-1-(4-ethyl-1,3-thiazol-2-yl)butan-2-amine.

Molecular Properties

Compound NameN-ethyl-1-(4-ethyl-1,3-thiazol-2-yl)butan-2-amine
PubChem CID63202023
Molecular FormulaC11H20N2S
Molecular Weight212.36 g/mol
Exact Mass212.13
IUPAC NameN-ethyl-1-(4-ethyl-1,3-thiazol-2-yl)butan-2-amine
SMILESCCNC(CC)Cc1nc(CC)cs1
InChIInChI=1S/C11H20N2S/c1-4-9(12-6-3)7-11-13-10(5-2)8-14-11/h8-9,12H,4-7H2,1-3H3
InChIKeySFNMNQHIILWSNU-UHFFFAOYSA-N
XLogP2.64
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.36
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-1-(4-methyl-1,3-thiazol-2-yl)butan-2-amine
CID 62795685
1-cyclopropyl-N-ethyl-2-(4-ethyl-1,3-thiazol-2-yl)ethanamine
CID 63355477
N-[(2-ethyl-1,3-thiazol-4-yl)methyl]pentan-3-amine
CID 60727178
1-(4-ethyl-1,3-thiazol-2-yl)butan-2-ol
CID 63201551
N-[(4-ethyl-1,3-thiazol-2-yl)methyl]propan-2-amine
CID 62544830
2-(2-chloropentyl)-4-ethyl-1,3-thiazole
CID 63203067
N-ethyl-1-[3-[(2-methyl-1,3-thiazol-4-yl)methyl]-1,2,4-oxadiazol-5-yl]butan-2-amine
CID 55201469
N-ethyl-5,5-dimethyl-1-(4-methyl-1,3-thiazol-2-yl)hexan-2-amine
CID 62794826
N-ethyl-1-(4-methylphenyl)-3-(4-methyl-1,3-thiazol-2-yl)propan-2-amine
CID 62796365
1-(4-propyl-1,3-thiazol-2-yl)propan-2-amine
CID 62652679
1-(4-tert-butyl-1,3-thiazol-2-yl)-N-ethyl-5,5,5-trifluoropentan-2-amine
CID 79954263
1-(5-bromo-2-pyridinyl)-N-ethyl-3-(4-methyl-1,3-thiazol-2-yl)propan-2-amine
CID 104801872

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(4-ethyl-1,3-thiazol-2-yl)butan-2-amine?
The IUPAC name of N-ethyl-1-(4-ethyl-1,3-thiazol-2-yl)butan-2-amine (CID 63202023) is N-ethyl-1-(4-ethyl-1,3-thiazol-2-yl)butan-2-amine.
What is the SMILES notation for N-ethyl-1-(4-ethyl-1,3-thiazol-2-yl)butan-2-amine?
The canonical SMILES for N-ethyl-1-(4-ethyl-1,3-thiazol-2-yl)butan-2-amine is CCNC(CC)Cc1nc(CC)cs1.
What is the InChIKey of N-ethyl-1-(4-ethyl-1,3-thiazol-2-yl)butan-2-amine?
The InChIKey is SFNMNQHIILWSNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2S/c1-4-9(12-6-3)7-11-13-10(5-2)8-14-11/h8-9,12H,4-7H2,1-3H3.
What are the key properties of N-ethyl-1-(4-ethyl-1,3-thiazol-2-yl)butan-2-amine?
N-ethyl-1-(4-ethyl-1,3-thiazol-2-yl)butan-2-amine has a molecular weight of 212.36 g/mol, XLogP of 2.64, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(4-ethyl-1,3-thiazol-2-yl)butan-2-amine is sourced from PubChem (CID 63202023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).