N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-1-(5-methylfuran-2-yl)ethanamine

C14H20N2OS — CID 86779546

IUPACN-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-1-(5-methylfuran-2-yl)ethanamine
SMILESCCc1cnc(C(C)NC(C)c2ccc(C)o2)s1
InChIInChI=1S/C14H20N2OS/c1-5-12-8-15-14(18-12)11(4)16-10(3)13-7-6-9(2)17-13/h6-8,10-11,16H,5H2,1-4H3
InChIKeyNBHHECNSWLFZDG-UHFFFAOYSA-N
MW264.39 g/mol
LogP4.02
Rot. Bonds5

About N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-1-(5-methylfuran-2-yl)ethanamine

N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-1-(5-methylfuran-2-yl)ethanamine (PubChem CID 86779546) has the molecular formula C14H20N2OS and a molecular weight of 264.39 g/mol. Its IUPAC name is N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-1-(5-methylfuran-2-yl)ethanamine.

Molecular Properties

Compound NameN-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-1-(5-methylfuran-2-yl)ethanamine
PubChem CID86779546
Molecular FormulaC14H20N2OS
Molecular Weight264.39 g/mol
Exact Mass264.13
IUPAC NameN-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-1-(5-methylfuran-2-yl)ethanamine
SMILESCCc1cnc(C(C)NC(C)c2ccc(C)o2)s1
InChIInChI=1S/C14H20N2OS/c1-5-12-8-15-14(18-12)11(4)16-10(3)13-7-6-9(2)17-13/h6-8,10-11,16H,5H2,1-4H3
InChIKeyNBHHECNSWLFZDG-UHFFFAOYSA-N
XLogP4.02
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.39
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-1-(5-methylfuran-2-yl)ethanamine?
The IUPAC name of N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-1-(5-methylfuran-2-yl)ethanamine (CID 86779546) is N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-1-(5-methylfuran-2-yl)ethanamine.
What is the SMILES notation for N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-1-(5-methylfuran-2-yl)ethanamine?
The canonical SMILES for N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-1-(5-methylfuran-2-yl)ethanamine is CCc1cnc(C(C)NC(C)c2ccc(C)o2)s1.
What is the InChIKey of N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-1-(5-methylfuran-2-yl)ethanamine?
The InChIKey is NBHHECNSWLFZDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2OS/c1-5-12-8-15-14(18-12)11(4)16-10(3)13-7-6-9(2)17-13/h6-8,10-11,16H,5H2,1-4H3.
What are the key properties of N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-1-(5-methylfuran-2-yl)ethanamine?
N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-1-(5-methylfuran-2-yl)ethanamine has a molecular weight of 264.39 g/mol, XLogP of 4.02, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(5-ethyl-1,3-thiazol-2-yl)ethyl]-1-(5-methylfuran-2-yl)ethanamine is sourced from PubChem (CID 86779546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).