4,5-dihydro-1,3-thiazol-2-amine;molecular hydrogen

C3H8N2S — CID 143157221

IUPAC4,5-dihydro-1,3-thiazol-2-amine;molecular hydrogen
SMILESNC1=NCCS1.[H][H]
InChIInChI=1S/C3H6N2S.H2/c4-3-5-1-2-6-3;/h1-2H2,(H2,4,5);1H
InChIKeyGZPOEYFQEKFVTF-UHFFFAOYSA-N
MW104.18 g/mol
LogP0.29
Rot. Bonds

About 4,5-dihydro-1,3-thiazol-2-amine;molecular hydrogen

4,5-dihydro-1,3-thiazol-2-amine;molecular hydrogen (PubChem CID 143157221) has the molecular formula C3H8N2S and a molecular weight of 104.18 g/mol. Its IUPAC name is 4,5-dihydro-1,3-thiazol-2-amine;molecular hydrogen.

Molecular Properties

Compound Name4,5-dihydro-1,3-thiazol-2-amine;molecular hydrogen
PubChem CID143157221
Molecular FormulaC3H8N2S
Molecular Weight104.18 g/mol
Exact Mass104.04
IUPAC Name4,5-dihydro-1,3-thiazol-2-amine;molecular hydrogen
SMILESNC1=NCCS1.[H][H]
InChIInChI=1S/C3H6N2S.H2/c4-3-5-1-2-6-3;/h1-2H2,(H2,4,5);1H
InChIKeyGZPOEYFQEKFVTF-UHFFFAOYSA-N
XLogP0.29
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500104.18
LogP ≤ 50.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4,5-dihydro-1,3-thiazol-2-amine;molecular hydrogen?
The IUPAC name of 4,5-dihydro-1,3-thiazol-2-amine;molecular hydrogen (CID 143157221) is 4,5-dihydro-1,3-thiazol-2-amine;molecular hydrogen.
What is the SMILES notation for 4,5-dihydro-1,3-thiazol-2-amine;molecular hydrogen?
The canonical SMILES for 4,5-dihydro-1,3-thiazol-2-amine;molecular hydrogen is NC1=NCCS1.[H][H].
What is the InChIKey of 4,5-dihydro-1,3-thiazol-2-amine;molecular hydrogen?
The InChIKey is GZPOEYFQEKFVTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H6N2S.H2/c4-3-5-1-2-6-3;/h1-2H2,(H2,4,5);1H.
What are the key properties of 4,5-dihydro-1,3-thiazol-2-amine;molecular hydrogen?
4,5-dihydro-1,3-thiazol-2-amine;molecular hydrogen has a molecular weight of 104.18 g/mol, XLogP of 0.29, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-dihydro-1,3-thiazol-2-amine;molecular hydrogen is sourced from PubChem (CID 143157221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).