2-[(1S)-1-aminoethyl]-1,3-thiazol-5-amine

C5H9N3S — CID 82417873

IUPAC2-[(1S)-1-aminoethyl]-1,3-thiazol-5-amine
SMILESC[C@H](N)c1ncc(N)s1
InChIInChI=1S/C5H9N3S/c1-3(6)5-8-2-4(7)9-5/h2-3H,6-7H2,1H3/t3-/m0/s1
InChIKeyGLXGNKBPHNSJCJ-VKHMYHEASA-N
MW143.22 g/mol
LogP0.75
Rot. Bonds1

About 2-[(1S)-1-aminoethyl]-1,3-thiazol-5-amine

2-[(1S)-1-aminoethyl]-1,3-thiazol-5-amine (PubChem CID 82417873) has the molecular formula C5H9N3S and a molecular weight of 143.22 g/mol. Its IUPAC name is 2-[(1S)-1-aminoethyl]-1,3-thiazol-5-amine.

Molecular Properties

Compound Name2-[(1S)-1-aminoethyl]-1,3-thiazol-5-amine
PubChem CID82417873
Molecular FormulaC5H9N3S
Molecular Weight143.22 g/mol
Exact Mass143.05
IUPAC Name2-[(1S)-1-aminoethyl]-1,3-thiazol-5-amine
SMILESC[C@H](N)c1ncc(N)s1
InChIInChI=1S/C5H9N3S/c1-3(6)5-8-2-4(7)9-5/h2-3H,6-7H2,1H3/t3-/m0/s1
InChIKeyGLXGNKBPHNSJCJ-VKHMYHEASA-N
XLogP0.75
TPSA64.93 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.22
LogP ≤ 50.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(1S)-1-aminoethyl]-1,3-thiazol-5-amine?
The IUPAC name of 2-[(1S)-1-aminoethyl]-1,3-thiazol-5-amine (CID 82417873) is 2-[(1S)-1-aminoethyl]-1,3-thiazol-5-amine.
What is the SMILES notation for 2-[(1S)-1-aminoethyl]-1,3-thiazol-5-amine?
The canonical SMILES for 2-[(1S)-1-aminoethyl]-1,3-thiazol-5-amine is C[C@H](N)c1ncc(N)s1.
What is the InChIKey of 2-[(1S)-1-aminoethyl]-1,3-thiazol-5-amine?
The InChIKey is GLXGNKBPHNSJCJ-VKHMYHEASA-N. The full InChI is InChI=1S/C5H9N3S/c1-3(6)5-8-2-4(7)9-5/h2-3H,6-7H2,1H3/t3-/m0/s1.
What are the key properties of 2-[(1S)-1-aminoethyl]-1,3-thiazol-5-amine?
2-[(1S)-1-aminoethyl]-1,3-thiazol-5-amine has a molecular weight of 143.22 g/mol, XLogP of 0.75, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1S)-1-aminoethyl]-1,3-thiazol-5-amine is sourced from PubChem (CID 82417873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).