N-ethyl-1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)propan-1-amine

C11H20N2S — CID 61330235

IUPACN-ethyl-1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)propan-1-amine
SMILESCCNC(CC)c1nc(CC)c(C)s1
InChIInChI=1S/C11H20N2S/c1-5-9-8(4)14-11(13-9)10(6-2)12-7-3/h10,12H,5-7H2,1-4H3
InChIKeyXKWSVCAXSAGADG-UHFFFAOYSA-N
MW212.36 g/mol
LogP3.07
Rot. Bonds5

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

N-ethyl-1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)propan-1-amine (PubChem CID 61330235) has the molecular formula C11H20N2S and a molecular weight of 212.36 g/mol. Its IUPAC name is N-ethyl-1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)propan-1-amine.

Molecular Properties

Compound NameN-ethyl-1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)propan-1-amine
PubChem CID61330235
Molecular FormulaC11H20N2S
Molecular Weight212.36 g/mol
Exact Mass212.13
IUPAC NameN-ethyl-1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)propan-1-amine
SMILESCCNC(CC)c1nc(CC)c(C)s1
InChIInChI=1S/C11H20N2S/c1-5-9-8(4)14-11(13-9)10(6-2)12-7-3/h10,12H,5-7H2,1-4H3
InChIKeyXKWSVCAXSAGADG-UHFFFAOYSA-N
XLogP3.07
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.36
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2,2-dimethylpropan-1-amine
CID 61330628
N-ethyl-1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-2,4-dimethylpentan-1-amine
CID 114201046
1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-N-propylheptan-1-amine
CID 63405862
N-[(4-ethyl-5-methyl-1,3-thiazol-2-yl)-phenylmethyl]ethanamine
CID 61332174
1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-N-methylheptan-1-amine
CID 61331537
1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-N,2,2-trimethylpropan-1-amine
CID 61332924
N-[(3-ethylimidazol-4-yl)-(4-ethyl-5-methyl-1,3-thiazol-2-yl)methyl]ethanamine
CID 66135561
1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-3-methoxy-3-methyl-N-propan-2-ylbutan-1-amine
CID 106676106
1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-N-(2-methoxyethyl)heptan-1-amine
CID 62544291
N-[(2-ethoxyphenyl)-(4-ethyl-5-methyl-1,3-thiazol-2-yl)methyl]ethanamine
CID 61332177
N-[(4-chloro-2-fluorophenyl)-(4-ethyl-5-methyl-1,3-thiazol-2-yl)methyl]ethanamine
CID 114859171
1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-3-methylbutan-1-amine
CID 61331303

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)propan-1-amine?
The IUPAC name of N-ethyl-1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)propan-1-amine (CID 61330235) is N-ethyl-1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)propan-1-amine.
What is the SMILES notation for N-ethyl-1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)propan-1-amine?
The canonical SMILES for N-ethyl-1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)propan-1-amine is CCNC(CC)c1nc(CC)c(C)s1.
What is the InChIKey of N-ethyl-1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)propan-1-amine?
The InChIKey is XKWSVCAXSAGADG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2S/c1-5-9-8(4)14-11(13-9)10(6-2)12-7-3/h10,12H,5-7H2,1-4H3.
What are the key properties of N-ethyl-1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)propan-1-amine?
N-ethyl-1-(4-ethyl-5-methyl-1,3-thiazol-2-yl)propan-1-amine has a molecular weight of 212.36 g/mol, XLogP of 3.07, 5 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-5-methyl-1,3-thiazol-2-yl)propan-1-amine is sourced from PubChem (CID 61330235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).