2-(2-methoxyethoxy)-N-(1,3-thiazol-2-ylmethyl)ethanamine

C9H16N2O2S — CID 63001390

IUPAC2-(2-methoxyethoxy)-N-(1,3-thiazol-2-ylmethyl)ethanamine
SMILESCOCCOCCNCc1nccs1
InChIInChI=1S/C9H16N2O2S/c1-12-5-6-13-4-2-10-8-9-11-3-7-14-9/h3,7,10H,2,4-6,8H2,1H3
InChIKeyNPNVRIDDJSGCQB-UHFFFAOYSA-N
MW216.31 g/mol
LogP0.90
Rot. Bonds8

About 2-(2-methoxyethoxy)-N-(1,3-thiazol-2-ylmethyl)ethanamine

2-(2-methoxyethoxy)-N-(1,3-thiazol-2-ylmethyl)ethanamine (PubChem CID 63001390) has the molecular formula C9H16N2O2S and a molecular weight of 216.31 g/mol. Its IUPAC name is 2-(2-methoxyethoxy)-N-(1,3-thiazol-2-ylmethyl)ethanamine.

Molecular Properties

Compound Name2-(2-methoxyethoxy)-N-(1,3-thiazol-2-ylmethyl)ethanamine
PubChem CID63001390
Molecular FormulaC9H16N2O2S
Molecular Weight216.31 g/mol
Exact Mass216.09
IUPAC Name2-(2-methoxyethoxy)-N-(1,3-thiazol-2-ylmethyl)ethanamine
SMILESCOCCOCCNCc1nccs1
InChIInChI=1S/C9H16N2O2S/c1-12-5-6-13-4-2-10-8-9-11-3-7-14-9/h3,7,10H,2,4-6,8H2,1H3
InChIKeyNPNVRIDDJSGCQB-UHFFFAOYSA-N
XLogP0.90
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.31
LogP ≤ 50.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-(2-methoxyethoxy)-N-(1,3-thiazol-2-ylmethyl)propan-1-amine
CID 62999936
2-[2-(1,3-thiazol-2-ylmethylamino)ethoxy]ethanol
CID 61283861
2-(2-methoxyethoxy)-N-(pyrimidin-2-ylmethyl)ethanamine
CID 62699364
N-[2-(2-methoxyethoxy)ethyl]-2-(1,3-thiazol-2-yl)propan-2-amine
CID 103738822
4-methoxy-1-N-(1,3-thiazol-2-ylmethyl)butane-1,2-diamine
CID 62477835
methyl 2-(1,3-thiazol-2-ylmethylamino)acetate
CID 61286040
2-(2-methoxyethoxy)-N-(pyrimidin-4-ylmethyl)ethanamine
CID 62747851
N-methyl-N'-(1,3-thiazol-2-ylmethyl)propane-1,3-diamine
CID 21021493
2-(2-methoxyethyl)-1,3-thiazole
CID 59275905
4-(2-methoxyethoxy)-1-(1,3-thiazol-2-yl)butan-2-amine
CID 102927833
2-methylsulfonyl-N-(1,3-thiazol-2-ylmethyl)ethanamine
CID 61283283
N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-2-(2-methoxyethoxy)ethanamine
CID 115331583

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyethoxy)-N-(1,3-thiazol-2-ylmethyl)ethanamine?
The IUPAC name of 2-(2-methoxyethoxy)-N-(1,3-thiazol-2-ylmethyl)ethanamine (CID 63001390) is 2-(2-methoxyethoxy)-N-(1,3-thiazol-2-ylmethyl)ethanamine.
What is the SMILES notation for 2-(2-methoxyethoxy)-N-(1,3-thiazol-2-ylmethyl)ethanamine?
The canonical SMILES for 2-(2-methoxyethoxy)-N-(1,3-thiazol-2-ylmethyl)ethanamine is COCCOCCNCc1nccs1.
What is the InChIKey of 2-(2-methoxyethoxy)-N-(1,3-thiazol-2-ylmethyl)ethanamine?
The InChIKey is NPNVRIDDJSGCQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O2S/c1-12-5-6-13-4-2-10-8-9-11-3-7-14-9/h3,7,10H,2,4-6,8H2,1H3.
What are the key properties of 2-(2-methoxyethoxy)-N-(1,3-thiazol-2-ylmethyl)ethanamine?
2-(2-methoxyethoxy)-N-(1,3-thiazol-2-ylmethyl)ethanamine has a molecular weight of 216.31 g/mol, XLogP of 0.90, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethoxy)-N-(1,3-thiazol-2-ylmethyl)ethanamine is sourced from PubChem (CID 63001390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).