5-[1-(ethylamino)ethyl]-N-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-2-amine

C10H16F3N3S — CID 55112015

IUPAC5-[1-(ethylamino)ethyl]-N-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-2-amine
SMILESCCNC(C)c1cnc(N(C)CC(F)(F)F)s1
InChIInChI=1S/C10H16F3N3S/c1-4-14-7(2)8-5-15-9(17-8)16(3)6-10(11,12)13/h5,7,14H,4,6H2,1-3H3
InChIKeyDQUSLIMCEUPLMV-UHFFFAOYSA-N
MW267.32 g/mol
LogP2.81
Rot. Bonds5

About 5-[1-(ethylamino)ethyl]-N-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-2-amine

5-[1-(ethylamino)ethyl]-N-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-2-amine (PubChem CID 55112015) has the molecular formula C10H16F3N3S and a molecular weight of 267.32 g/mol. Its IUPAC name is 5-[1-(ethylamino)ethyl]-N-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-[1-(ethylamino)ethyl]-N-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-2-amine
PubChem CID55112015
Molecular FormulaC10H16F3N3S
Molecular Weight267.32 g/mol
Exact Mass267.10
IUPAC Name5-[1-(ethylamino)ethyl]-N-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-2-amine
SMILESCCNC(C)c1cnc(N(C)CC(F)(F)F)s1
InChIInChI=1S/C10H16F3N3S/c1-4-14-7(2)8-5-15-9(17-8)16(3)6-10(11,12)13/h5,7,14H,4,6H2,1-3H3
InChIKeyDQUSLIMCEUPLMV-UHFFFAOYSA-N
XLogP2.81
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.32
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-[1-(ethylamino)ethyl]-N-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-2-amine?
The IUPAC name of 5-[1-(ethylamino)ethyl]-N-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-2-amine (CID 55112015) is 5-[1-(ethylamino)ethyl]-N-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 5-[1-(ethylamino)ethyl]-N-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-2-amine?
The canonical SMILES for 5-[1-(ethylamino)ethyl]-N-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-2-amine is CCNC(C)c1cnc(N(C)CC(F)(F)F)s1.
What is the InChIKey of 5-[1-(ethylamino)ethyl]-N-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-2-amine?
The InChIKey is DQUSLIMCEUPLMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16F3N3S/c1-4-14-7(2)8-5-15-9(17-8)16(3)6-10(11,12)13/h5,7,14H,4,6H2,1-3H3.
What are the key properties of 5-[1-(ethylamino)ethyl]-N-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-2-amine?
5-[1-(ethylamino)ethyl]-N-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-2-amine has a molecular weight of 267.32 g/mol, XLogP of 2.81, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[1-(ethylamino)ethyl]-N-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 55112015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).