2-N-ethyl-1,3-thiazole-2,4-diamine

C5H9N3S — CID 117189257

IUPAC2-N-ethyl-1,3-thiazole-2,4-diamine
SMILESCCNc1nc(N)cs1
InChIInChI=1S/C5H9N3S/c1-2-7-5-8-4(6)3-9-5/h3H,2,6H2,1H3,(H,7,8)
InChIKeyJFSWOKHKFCZSOA-UHFFFAOYSA-N
MW143.22 g/mol
LogP1.16
Rot. Bonds2

About 2-N-ethyl-1,3-thiazole-2,4-diamine

2-N-ethyl-1,3-thiazole-2,4-diamine (PubChem CID 117189257) has the molecular formula C5H9N3S and a molecular weight of 143.22 g/mol. Its IUPAC name is 2-N-ethyl-1,3-thiazole-2,4-diamine.

Molecular Properties

Compound Name2-N-ethyl-1,3-thiazole-2,4-diamine
PubChem CID117189257
Molecular FormulaC5H9N3S
Molecular Weight143.22 g/mol
Exact Mass143.05
IUPAC Name2-N-ethyl-1,3-thiazole-2,4-diamine
SMILESCCNc1nc(N)cs1
InChIInChI=1S/C5H9N3S/c1-2-7-5-8-4(6)3-9-5/h3H,2,6H2,1H3,(H,7,8)
InChIKeyJFSWOKHKFCZSOA-UHFFFAOYSA-N
XLogP1.16
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.22
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-N-ethyl-1,3-thiazole-2,4-diamine?
The IUPAC name of 2-N-ethyl-1,3-thiazole-2,4-diamine (CID 117189257) is 2-N-ethyl-1,3-thiazole-2,4-diamine.
What is the SMILES notation for 2-N-ethyl-1,3-thiazole-2,4-diamine?
The canonical SMILES for 2-N-ethyl-1,3-thiazole-2,4-diamine is CCNc1nc(N)cs1.
What is the InChIKey of 2-N-ethyl-1,3-thiazole-2,4-diamine?
The InChIKey is JFSWOKHKFCZSOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9N3S/c1-2-7-5-8-4(6)3-9-5/h3H,2,6H2,1H3,(H,7,8).
What are the key properties of 2-N-ethyl-1,3-thiazole-2,4-diamine?
2-N-ethyl-1,3-thiazole-2,4-diamine has a molecular weight of 143.22 g/mol, XLogP of 1.16, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-ethyl-1,3-thiazole-2,4-diamine is sourced from PubChem (CID 117189257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).