N-ethyl-N-[4-[[1-(furan-2-yl)ethylamino]methyl]-1,3-thiazol-2-yl]acetamide

C14H19N3O2S — CID 43226378

IUPACN-ethyl-N-[4-[[1-(furan-2-yl)ethylamino]methyl]-1,3-thiazol-2-yl]acetamide
SMILESCCN(C(C)=O)c1nc(CNC(C)c2ccco2)cs1
InChIInChI=1S/C14H19N3O2S/c1-4-17(11(3)18)14-16-12(9-20-14)8-15-10(2)13-6-5-7-19-13/h5-7,9-10,15H,4,8H2,1-3H3
InChIKeyINRXNHAZLCLKIA-UHFFFAOYSA-N
MW293.39 g/mol
LogP2.96
Rot. Bonds6

About N-ethyl-N-[4-[[1-(furan-2-yl)ethylamino]methyl]-1,3-thiazol-2-yl]acetamide

N-ethyl-N-[4-[[1-(furan-2-yl)ethylamino]methyl]-1,3-thiazol-2-yl]acetamide (PubChem CID 43226378) has the molecular formula C14H19N3O2S and a molecular weight of 293.39 g/mol. Its IUPAC name is N-ethyl-N-[4-[[1-(furan-2-yl)ethylamino]methyl]-1,3-thiazol-2-yl]acetamide.

Molecular Properties

Compound NameN-ethyl-N-[4-[[1-(furan-2-yl)ethylamino]methyl]-1,3-thiazol-2-yl]acetamide
PubChem CID43226378
Molecular FormulaC14H19N3O2S
Molecular Weight293.39 g/mol
Exact Mass293.12
IUPAC NameN-ethyl-N-[4-[[1-(furan-2-yl)ethylamino]methyl]-1,3-thiazol-2-yl]acetamide
SMILESCCN(C(C)=O)c1nc(CNC(C)c2ccco2)cs1
InChIInChI=1S/C14H19N3O2S/c1-4-17(11(3)18)14-16-12(9-20-14)8-15-10(2)13-6-5-7-19-13/h5-7,9-10,15H,4,8H2,1-3H3
InChIKeyINRXNHAZLCLKIA-UHFFFAOYSA-N
XLogP2.96
TPSA58.37 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.39
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-ethyl-N-[4-[(1-methoxypropan-2-ylamino)methyl]-1,3-thiazol-2-yl]acetamide
CID 43226283
N-[4-[(2,3-dimethylbutylamino)methyl]-1,3-thiazol-2-yl]-N-ethylacetamide
CID 64569654
N-ethyl-N-[4-[[1-(oxolan-3-yl)ethylamino]methyl]-1,3-thiazol-2-yl]acetamide
CID 115655333
N-ethyl-N-[4-[(4-hydroxyanilino)methyl]-1,3-thiazol-2-yl]acetamide
CID 43742880
N-ethyl-N-[4-[(4-iodoanilino)methyl]-1,3-thiazol-2-yl]acetamide
CID 43226209
N-[4-[(2,3-dihydroxypropylamino)methyl]-1,3-thiazol-2-yl]-N-ethylacetamide
CID 66177601
N-ethyl-N-[4-[[(1-methylpyrazol-3-yl)methylamino]methyl]-1,3-thiazol-2-yl]acetamide
CID 82882559
1-(furan-2-yl)-N-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methyl]ethanamine
CID 43234418
(1R)-1-(furan-2-yl)-N-(1,3-thiazol-4-ylmethyl)ethanamine
CID 81401203
N-ethyl-N-[4-[(1,3-thiazol-2-ylamino)methyl]-1,3-thiazol-2-yl]acetamide
CID 79046167
N-ethyl-N-[4-[(1,2,4-oxadiazol-3-ylmethylamino)methyl]-1,3-thiazol-2-yl]acetamide
CID 106393105
[2-[acetyl(ethyl)amino]-1,3-thiazol-4-yl]methyl 5-(furan-2-ylmethylsulfamoyl)-2-methylbenzoate
CID 55323218

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-[4-[[1-(furan-2-yl)ethylamino]methyl]-1,3-thiazol-2-yl]acetamide?
The IUPAC name of N-ethyl-N-[4-[[1-(furan-2-yl)ethylamino]methyl]-1,3-thiazol-2-yl]acetamide (CID 43226378) is N-ethyl-N-[4-[[1-(furan-2-yl)ethylamino]methyl]-1,3-thiazol-2-yl]acetamide.
What is the SMILES notation for N-ethyl-N-[4-[[1-(furan-2-yl)ethylamino]methyl]-1,3-thiazol-2-yl]acetamide?
The canonical SMILES for N-ethyl-N-[4-[[1-(furan-2-yl)ethylamino]methyl]-1,3-thiazol-2-yl]acetamide is CCN(C(C)=O)c1nc(CNC(C)c2ccco2)cs1.
What is the InChIKey of N-ethyl-N-[4-[[1-(furan-2-yl)ethylamino]methyl]-1,3-thiazol-2-yl]acetamide?
The InChIKey is INRXNHAZLCLKIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2S/c1-4-17(11(3)18)14-16-12(9-20-14)8-15-10(2)13-6-5-7-19-13/h5-7,9-10,15H,4,8H2,1-3H3.
What are the key properties of N-ethyl-N-[4-[[1-(furan-2-yl)ethylamino]methyl]-1,3-thiazol-2-yl]acetamide?
N-ethyl-N-[4-[[1-(furan-2-yl)ethylamino]methyl]-1,3-thiazol-2-yl]acetamide has a molecular weight of 293.39 g/mol, XLogP of 2.96, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-[4-[[1-(furan-2-yl)ethylamino]methyl]-1,3-thiazol-2-yl]acetamide is sourced from PubChem (CID 43226378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).