N,N-diethyl-2-(1,3-thiazol-2-yloxy)ethanamine

C9H16N2OS — CID 59693847

IUPACN,N-diethyl-2-(1,3-thiazol-2-yloxy)ethanamine
SMILESCCN(CC)CCOc1nccs1
InChIInChI=1S/C9H16N2OS/c1-3-11(4-2)6-7-12-9-10-5-8-13-9/h5,8H,3-4,6-7H2,1-2H3
InChIKeyNOLVJADSEKUALI-UHFFFAOYSA-N
MW200.31 g/mol
LogP1.86
Rot. Bonds6

About N,N-diethyl-2-(1,3-thiazol-2-yloxy)ethanamine

N,N-diethyl-2-(1,3-thiazol-2-yloxy)ethanamine (PubChem CID 59693847) has the molecular formula C9H16N2OS and a molecular weight of 200.31 g/mol. Its IUPAC name is N,N-diethyl-2-(1,3-thiazol-2-yloxy)ethanamine.

Molecular Properties

Compound NameN,N-diethyl-2-(1,3-thiazol-2-yloxy)ethanamine
PubChem CID59693847
Molecular FormulaC9H16N2OS
Molecular Weight200.31 g/mol
Exact Mass200.10
IUPAC NameN,N-diethyl-2-(1,3-thiazol-2-yloxy)ethanamine
SMILESCCN(CC)CCOc1nccs1
InChIInChI=1S/C9H16N2OS/c1-3-11(4-2)6-7-12-9-10-5-8-13-9/h5,8H,3-4,6-7H2,1-2H3
InChIKeyNOLVJADSEKUALI-UHFFFAOYSA-N
XLogP1.86
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.31
LogP ≤ 51.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-(1,3-thiazol-2-yloxy)ethanamine?
The IUPAC name of N,N-diethyl-2-(1,3-thiazol-2-yloxy)ethanamine (CID 59693847) is N,N-diethyl-2-(1,3-thiazol-2-yloxy)ethanamine.
What is the SMILES notation for N,N-diethyl-2-(1,3-thiazol-2-yloxy)ethanamine?
The canonical SMILES for N,N-diethyl-2-(1,3-thiazol-2-yloxy)ethanamine is CCN(CC)CCOc1nccs1.
What is the InChIKey of N,N-diethyl-2-(1,3-thiazol-2-yloxy)ethanamine?
The InChIKey is NOLVJADSEKUALI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2OS/c1-3-11(4-2)6-7-12-9-10-5-8-13-9/h5,8H,3-4,6-7H2,1-2H3.
What are the key properties of N,N-diethyl-2-(1,3-thiazol-2-yloxy)ethanamine?
N,N-diethyl-2-(1,3-thiazol-2-yloxy)ethanamine has a molecular weight of 200.31 g/mol, XLogP of 1.86, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-(1,3-thiazol-2-yloxy)ethanamine is sourced from PubChem (CID 59693847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).