5-(2-propoxyethyl)-1,3-thiazol-2-amine

C8H14N2OS — CID 106458138

IUPAC5-(2-propoxyethyl)-1,3-thiazol-2-amine
SMILESCCCOCCc1cnc(N)s1
InChIInChI=1S/C8H14N2OS/c1-2-4-11-5-3-7-6-10-8(9)12-7/h6H,2-5H2,1H3,(H2,9,10)
InChIKeyDHYCUALEEIIFDO-UHFFFAOYSA-N
MW186.28 g/mol
LogP1.69
Rot. Bonds5

About 5-(2-propoxyethyl)-1,3-thiazol-2-amine

5-(2-propoxyethyl)-1,3-thiazol-2-amine (PubChem CID 106458138) has the molecular formula C8H14N2OS and a molecular weight of 186.28 g/mol. Its IUPAC name is 5-(2-propoxyethyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-(2-propoxyethyl)-1,3-thiazol-2-amine
PubChem CID106458138
Molecular FormulaC8H14N2OS
Molecular Weight186.28 g/mol
Exact Mass186.08
IUPAC Name5-(2-propoxyethyl)-1,3-thiazol-2-amine
SMILESCCCOCCc1cnc(N)s1
InChIInChI=1S/C8H14N2OS/c1-2-4-11-5-3-7-6-10-8(9)12-7/h6H,2-5H2,1H3,(H2,9,10)
InChIKeyDHYCUALEEIIFDO-UHFFFAOYSA-N
XLogP1.69
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.28
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-(2-propoxyethyl)-1,3-thiazol-2-amine?
The IUPAC name of 5-(2-propoxyethyl)-1,3-thiazol-2-amine (CID 106458138) is 5-(2-propoxyethyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 5-(2-propoxyethyl)-1,3-thiazol-2-amine?
The canonical SMILES for 5-(2-propoxyethyl)-1,3-thiazol-2-amine is CCCOCCc1cnc(N)s1.
What is the InChIKey of 5-(2-propoxyethyl)-1,3-thiazol-2-amine?
The InChIKey is DHYCUALEEIIFDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2OS/c1-2-4-11-5-3-7-6-10-8(9)12-7/h6H,2-5H2,1H3,(H2,9,10).
What are the key properties of 5-(2-propoxyethyl)-1,3-thiazol-2-amine?
5-(2-propoxyethyl)-1,3-thiazol-2-amine has a molecular weight of 186.28 g/mol, XLogP of 1.69, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-propoxyethyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 106458138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).