4-(2-aminoethyl)-1,3-thiazol-2-amine

C5H9N3S — CID 10964631

IUPAC4-(2-aminoethyl)-1,3-thiazol-2-amine
SMILESNCCc1csc(N)n1
InChIInChI=1S/C5H9N3S/c6-2-1-4-3-9-5(7)8-4/h3H,1-2,6H2,(H2,7,8)
InChIKeyAWGAMNRCCCIYLX-UHFFFAOYSA-N
MW143.22 g/mol
LogP0.23
Rot. Bonds2

About 4-(2-aminoethyl)-1,3-thiazol-2-amine

4-(2-aminoethyl)-1,3-thiazol-2-amine (PubChem CID 10964631) has the molecular formula C5H9N3S and a molecular weight of 143.22 g/mol. Its IUPAC name is 4-(2-aminoethyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-(2-aminoethyl)-1,3-thiazol-2-amine
PubChem CID10964631
Molecular FormulaC5H9N3S
Molecular Weight143.22 g/mol
Exact Mass143.05
IUPAC Name4-(2-aminoethyl)-1,3-thiazol-2-amine
SMILESNCCc1csc(N)n1
InChIInChI=1S/C5H9N3S/c6-2-1-4-3-9-5(7)8-4/h3H,1-2,6H2,(H2,7,8)
InChIKeyAWGAMNRCCCIYLX-UHFFFAOYSA-N
XLogP0.23
TPSA64.93 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 ≤ 50.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(2-aminoethyl)-1,3-thiazol-2-amine?
The IUPAC name of 4-(2-aminoethyl)-1,3-thiazol-2-amine (CID 10964631) is 4-(2-aminoethyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 4-(2-aminoethyl)-1,3-thiazol-2-amine?
The canonical SMILES for 4-(2-aminoethyl)-1,3-thiazol-2-amine is NCCc1csc(N)n1.
What is the InChIKey of 4-(2-aminoethyl)-1,3-thiazol-2-amine?
The InChIKey is AWGAMNRCCCIYLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9N3S/c6-2-1-4-3-9-5(7)8-4/h3H,1-2,6H2,(H2,7,8).
What are the key properties of 4-(2-aminoethyl)-1,3-thiazol-2-amine?
4-(2-aminoethyl)-1,3-thiazol-2-amine has a molecular weight of 143.22 g/mol, XLogP of 0.23, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-aminoethyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 10964631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).