1-(2,5-dimethyl-1,3-thiazol-4-yl)-N-ethylethanamine

C9H16N2S — CID 43200501

IUPAC1-(2,5-dimethyl-1,3-thiazol-4-yl)-N-ethylethanamine
SMILESCCNC(C)c1nc(C)sc1C
InChIInChI=1S/C9H16N2S/c1-5-10-6(2)9-7(3)12-8(4)11-9/h6,10H,5H2,1-4H3
InChIKeyMVNYMEQJXLNWLY-UHFFFAOYSA-N
MW184.31 g/mol
LogP2.43
Rot. Bonds3

About 1-(2,5-dimethyl-1,3-thiazol-4-yl)-N-ethylethanamine

1-(2,5-dimethyl-1,3-thiazol-4-yl)-N-ethylethanamine (PubChem CID 43200501) has the molecular formula C9H16N2S and a molecular weight of 184.31 g/mol. Its IUPAC name is 1-(2,5-dimethyl-1,3-thiazol-4-yl)-N-ethylethanamine.

Molecular Properties

Compound Name1-(2,5-dimethyl-1,3-thiazol-4-yl)-N-ethylethanamine
PubChem CID43200501
Molecular FormulaC9H16N2S
Molecular Weight184.31 g/mol
Exact Mass184.10
IUPAC Name1-(2,5-dimethyl-1,3-thiazol-4-yl)-N-ethylethanamine
SMILESCCNC(C)c1nc(C)sc1C
InChIInChI=1S/C9H16N2S/c1-5-10-6(2)9-7(3)12-8(4)11-9/h6,10H,5H2,1-4H3
InChIKeyMVNYMEQJXLNWLY-UHFFFAOYSA-N
XLogP2.43
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.31
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N'-[1-(2,5-dimethyl-1,3-thiazol-4-yl)ethyl]propane-1,3-diamine
CID 60888751
N-(cyclopropylmethyl)-1-(2,5-dimethyl-1,3-thiazol-4-yl)ethanamine
CID 43200773
N-[1-(2,5-dimethyl-1,3-thiazol-4-yl)ethyl]-2,2-diethoxyethanamine
CID 79547946
N-[1-(2,5-dimethyl-1,3-thiazol-4-yl)ethyl]-N'-ethyl-N'-methylethane-1,2-diamine
CID 62635360
(1R)-1-(2,5-dimethyl-1,3-thiazol-4-yl)-N-methylethanamine
CID 26722635
1-(2,5-dimethyl-1,3-thiazol-4-yl)-N-[(2-methylcyclopropyl)methyl]ethanamine
CID 115753105
1-(2,5-dimethyl-1,3-thiazol-4-yl)-N-[(1-methylcyclopropyl)methyl]ethanamine
CID 103902867
N-[1-(2,5-dimethyl-1,3-thiazol-4-yl)ethyl]-N'-ethyl-N'-propylethane-1,2-diamine
CID 113278109
1-N-[1-(2,5-dimethyl-1,3-thiazol-4-yl)ethyl]-2-N,2-N,3-trimethylbutane-1,2-diamine
CID 43205593
2-[1-(2,5-dimethyl-1,3-thiazol-4-yl)ethylamino]-N-propylacetamide
CID 43567206
2-[1-(2,5-dimethyl-1,3-thiazol-4-yl)ethylamino]-N,N-dimethylacetamide
CID 43310810
methyl 3-[1-(2,5-dimethyl-1,3-thiazol-4-yl)ethylamino]propanoate
CID 43139664

Frequently Asked Questions

What is the IUPAC name of 1-(2,5-dimethyl-1,3-thiazol-4-yl)-N-ethylethanamine?
The IUPAC name of 1-(2,5-dimethyl-1,3-thiazol-4-yl)-N-ethylethanamine (CID 43200501) is 1-(2,5-dimethyl-1,3-thiazol-4-yl)-N-ethylethanamine.
What is the SMILES notation for 1-(2,5-dimethyl-1,3-thiazol-4-yl)-N-ethylethanamine?
The canonical SMILES for 1-(2,5-dimethyl-1,3-thiazol-4-yl)-N-ethylethanamine is CCNC(C)c1nc(C)sc1C.
What is the InChIKey of 1-(2,5-dimethyl-1,3-thiazol-4-yl)-N-ethylethanamine?
The InChIKey is MVNYMEQJXLNWLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2S/c1-5-10-6(2)9-7(3)12-8(4)11-9/h6,10H,5H2,1-4H3.
What are the key properties of 1-(2,5-dimethyl-1,3-thiazol-4-yl)-N-ethylethanamine?
1-(2,5-dimethyl-1,3-thiazol-4-yl)-N-ethylethanamine has a molecular weight of 184.31 g/mol, XLogP of 2.43, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-dimethyl-1,3-thiazol-4-yl)-N-ethylethanamine is sourced from PubChem (CID 43200501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).