N-ethyl-4-[1-(ethylamino)ethyl]-N-(4-fluorophenyl)-1,3-thiazol-2-amine

C15H20FN3S — CID 64543753

IUPACN-ethyl-4-[1-(ethylamino)ethyl]-N-(4-fluorophenyl)-1,3-thiazol-2-amine
SMILESCCNC(C)c1csc(N(CC)c2ccc(F)cc2)n1
InChIInChI=1S/C15H20FN3S/c1-4-17-11(3)14-10-20-15(18-14)19(5-2)13-8-6-12(16)7-9-13/h6-11,17H,4-5H2,1-3H3
InChIKeyLYMYENUHVXPLNH-UHFFFAOYSA-N
MW293.41 g/mol
LogP4.11
Rot. Bonds6

About N-ethyl-4-[1-(ethylamino)ethyl]-N-(4-fluorophenyl)-1,3-thiazol-2-amine

N-ethyl-4-[1-(ethylamino)ethyl]-N-(4-fluorophenyl)-1,3-thiazol-2-amine (PubChem CID 64543753) has the molecular formula C15H20FN3S and a molecular weight of 293.41 g/mol. Its IUPAC name is N-ethyl-4-[1-(ethylamino)ethyl]-N-(4-fluorophenyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-ethyl-4-[1-(ethylamino)ethyl]-N-(4-fluorophenyl)-1,3-thiazol-2-amine
PubChem CID64543753
Molecular FormulaC15H20FN3S
Molecular Weight293.41 g/mol
Exact Mass293.14
IUPAC NameN-ethyl-4-[1-(ethylamino)ethyl]-N-(4-fluorophenyl)-1,3-thiazol-2-amine
SMILESCCNC(C)c1csc(N(CC)c2ccc(F)cc2)n1
InChIInChI=1S/C15H20FN3S/c1-4-17-11(3)14-10-20-15(18-14)19(5-2)13-8-6-12(16)7-9-13/h6-11,17H,4-5H2,1-3H3
InChIKeyLYMYENUHVXPLNH-UHFFFAOYSA-N
XLogP4.11
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.41
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-4-[1-(ethylamino)ethyl]-N-(4-methylphenyl)-1,3-thiazol-2-amine
CID 64543756
4-[1-(ethylamino)ethyl]-N-(4-fluorophenyl)-N-methyl-1,3-thiazol-2-amine
CID 64544155
N-ethyl-4-[1-(ethylamino)ethyl]-N-(3-fluorophenyl)-1,3-thiazol-2-amine
CID 64542740
N,N-diethyl-4-[1-(ethylamino)ethyl]-1,3-thiazol-2-amine
CID 64542709
4-[1-(ethylamino)ethyl]-N,N-dimethyl-1,3-thiazol-2-amine
CID 64542711
4-[1-(ethylamino)ethyl]-N-methyl-N-propan-2-yl-1,3-thiazol-2-amine
CID 64545140
4-[1-(ethylamino)ethyl]-N-[(3-fluorophenyl)methyl]-N-methyl-1,3-thiazol-2-amine
CID 64542716
4-[1-(ethylamino)ethyl]-N-methyl-N-(3-methylbutan-2-yl)-1,3-thiazol-2-amine
CID 64542925
4-[1-(ethylamino)ethyl]-N,N-bis(3-methylbutyl)-1,3-thiazol-2-amine
CID 107871475
N-[1-(4-chlorophenyl)ethyl]-4-[1-(ethylamino)ethyl]-N-methyl-1,3-thiazol-2-amine
CID 64542556
4-[1-(ethylamino)ethyl]-N-methyl-N-[(5-methylfuran-2-yl)methyl]-1,3-thiazol-2-amine
CID 64544545
N-cyclopropyl-4-[1-(ethylamino)ethyl]-N-(2-methylpropyl)-1,3-thiazol-2-amine
CID 64543352

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-[1-(ethylamino)ethyl]-N-(4-fluorophenyl)-1,3-thiazol-2-amine?
The IUPAC name of N-ethyl-4-[1-(ethylamino)ethyl]-N-(4-fluorophenyl)-1,3-thiazol-2-amine (CID 64543753) is N-ethyl-4-[1-(ethylamino)ethyl]-N-(4-fluorophenyl)-1,3-thiazol-2-amine.
What is the SMILES notation for N-ethyl-4-[1-(ethylamino)ethyl]-N-(4-fluorophenyl)-1,3-thiazol-2-amine?
The canonical SMILES for N-ethyl-4-[1-(ethylamino)ethyl]-N-(4-fluorophenyl)-1,3-thiazol-2-amine is CCNC(C)c1csc(N(CC)c2ccc(F)cc2)n1.
What is the InChIKey of N-ethyl-4-[1-(ethylamino)ethyl]-N-(4-fluorophenyl)-1,3-thiazol-2-amine?
The InChIKey is LYMYENUHVXPLNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20FN3S/c1-4-17-11(3)14-10-20-15(18-14)19(5-2)13-8-6-12(16)7-9-13/h6-11,17H,4-5H2,1-3H3.
What are the key properties of N-ethyl-4-[1-(ethylamino)ethyl]-N-(4-fluorophenyl)-1,3-thiazol-2-amine?
N-ethyl-4-[1-(ethylamino)ethyl]-N-(4-fluorophenyl)-1,3-thiazol-2-amine has a molecular weight of 293.41 g/mol, XLogP of 4.11, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-[1-(ethylamino)ethyl]-N-(4-fluorophenyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 64543753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).