5-(3-aminoprop-2-enyl)-1,3-thiazol-2-amine

C6H9N3S — CID 173353662

IUPAC5-(3-aminoprop-2-enyl)-1,3-thiazol-2-amine
SMILESNC=CCc1cnc(N)s1
InChIInChI=1S/C6H9N3S/c7-3-1-2-5-4-9-6(8)10-5/h1,3-4H,2,7H2,(H2,8,9)
InChIKeyIWOZCPACPXEUKR-UHFFFAOYSA-N
MW155.23 g/mol
LogP0.74
Rot. Bonds2

About 5-(3-aminoprop-2-enyl)-1,3-thiazol-2-amine

5-(3-aminoprop-2-enyl)-1,3-thiazol-2-amine (PubChem CID 173353662) has the molecular formula C6H9N3S and a molecular weight of 155.23 g/mol. Its IUPAC name is 5-(3-aminoprop-2-enyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-(3-aminoprop-2-enyl)-1,3-thiazol-2-amine
PubChem CID173353662
Molecular FormulaC6H9N3S
Molecular Weight155.23 g/mol
Exact Mass155.05
IUPAC Name5-(3-aminoprop-2-enyl)-1,3-thiazol-2-amine
SMILESNC=CCc1cnc(N)s1
InChIInChI=1S/C6H9N3S/c7-3-1-2-5-4-9-6(8)10-5/h1,3-4H,2,7H2,(H2,8,9)
InChIKeyIWOZCPACPXEUKR-UHFFFAOYSA-N
XLogP0.74
TPSA64.93 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.23
LogP ≤ 50.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(3-aminoprop-2-enyl)-1,3-thiazol-2-amine?
The IUPAC name of 5-(3-aminoprop-2-enyl)-1,3-thiazol-2-amine (CID 173353662) is 5-(3-aminoprop-2-enyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 5-(3-aminoprop-2-enyl)-1,3-thiazol-2-amine?
The canonical SMILES for 5-(3-aminoprop-2-enyl)-1,3-thiazol-2-amine is NC=CCc1cnc(N)s1.
What is the InChIKey of 5-(3-aminoprop-2-enyl)-1,3-thiazol-2-amine?
The InChIKey is IWOZCPACPXEUKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3S/c7-3-1-2-5-4-9-6(8)10-5/h1,3-4H,2,7H2,(H2,8,9).
What are the key properties of 5-(3-aminoprop-2-enyl)-1,3-thiazol-2-amine?
5-(3-aminoprop-2-enyl)-1,3-thiazol-2-amine has a molecular weight of 155.23 g/mol, XLogP of 0.74, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-aminoprop-2-enyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 173353662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).