2-[3-(2-methoxyethoxy)propoxy]-1,3-thiazol-5-amine

C9H16N2O3S — CID 103400965

IUPAC2-[3-(2-methoxyethoxy)propoxy]-1,3-thiazol-5-amine
SMILESCOCCOCCCOc1ncc(N)s1
InChIInChI=1S/C9H16N2O3S/c1-12-5-6-13-3-2-4-14-9-11-7-8(10)15-9/h7H,2-6,10H2,1H3
InChIKeyVKZANNCCMCSKJM-UHFFFAOYSA-N
MW232.30 g/mol
LogP1.16
Rot. Bonds8

About 2-[3-(2-methoxyethoxy)propoxy]-1,3-thiazol-5-amine

2-[3-(2-methoxyethoxy)propoxy]-1,3-thiazol-5-amine (PubChem CID 103400965) has the molecular formula C9H16N2O3S and a molecular weight of 232.30 g/mol. Its IUPAC name is 2-[3-(2-methoxyethoxy)propoxy]-1,3-thiazol-5-amine.

Molecular Properties

Compound Name2-[3-(2-methoxyethoxy)propoxy]-1,3-thiazol-5-amine
PubChem CID103400965
Molecular FormulaC9H16N2O3S
Molecular Weight232.30 g/mol
Exact Mass232.09
IUPAC Name2-[3-(2-methoxyethoxy)propoxy]-1,3-thiazol-5-amine
SMILESCOCCOCCCOc1ncc(N)s1
InChIInChI=1S/C9H16N2O3S/c1-12-5-6-13-3-2-4-14-9-11-7-8(10)15-9/h7H,2-6,10H2,1H3
InChIKeyVKZANNCCMCSKJM-UHFFFAOYSA-N
XLogP1.16
TPSA66.60 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.30
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

2-[2-(dimethylamino)ethoxy]-1,3-thiazol-5-amine
CID 102769438
5-bromo-2-[3-(2-methoxyethoxy)propoxy]pyridin-3-amine
CID 103400992
2-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]-1,3-thiazol-5-amine
CID 102769344
6-[2-(3-methoxypropoxy)ethoxy]pyridin-3-amine
CID 103176771
5-(2-methoxyethoxymethyl)-1,3-thiazol-2-amine
CID 79775147
5-[2-(3-methoxypropoxy)ethoxy]pyridin-3-amine
CID 103176470
3-[3-(2-methoxyethoxy)propoxy]pyrazine-2-carbothioamide
CID 103402515
1-(2-methoxyethoxy)-4-[4-(2-methoxyethoxy)butoxy]butane
CID 58114561
2-methoxyethyl 2-(2-methoxyethoxy)-1,3-thiazole-5-carboxylate
CID 126503353
3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-(2-methoxyethoxy)propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propan-1-ol
CID 155650334
2-[2-[3-[2-(2-methoxyethoxy)ethoxy]propoxy]ethoxy]ethanamine
CID 146320426
2-[2-[3-(2-methoxyethoxy)propoxy]ethoxy]ethanamine
CID 103482612

Frequently Asked Questions

What is the IUPAC name of 2-[3-(2-methoxyethoxy)propoxy]-1,3-thiazol-5-amine?
The IUPAC name of 2-[3-(2-methoxyethoxy)propoxy]-1,3-thiazol-5-amine (CID 103400965) is 2-[3-(2-methoxyethoxy)propoxy]-1,3-thiazol-5-amine.
What is the SMILES notation for 2-[3-(2-methoxyethoxy)propoxy]-1,3-thiazol-5-amine?
The canonical SMILES for 2-[3-(2-methoxyethoxy)propoxy]-1,3-thiazol-5-amine is COCCOCCCOc1ncc(N)s1.
What is the InChIKey of 2-[3-(2-methoxyethoxy)propoxy]-1,3-thiazol-5-amine?
The InChIKey is VKZANNCCMCSKJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O3S/c1-12-5-6-13-3-2-4-14-9-11-7-8(10)15-9/h7H,2-6,10H2,1H3.
What are the key properties of 2-[3-(2-methoxyethoxy)propoxy]-1,3-thiazol-5-amine?
2-[3-(2-methoxyethoxy)propoxy]-1,3-thiazol-5-amine has a molecular weight of 232.30 g/mol, XLogP of 1.16, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(2-methoxyethoxy)propoxy]-1,3-thiazol-5-amine is sourced from PubChem (CID 103400965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).