5-(aminomethyl)-4-methyl-1,3-thiazol-2-amine

C5H9N3S — CID 24820452

IUPAC5-(aminomethyl)-4-methyl-1,3-thiazol-2-amine
SMILESCc1nc(N)sc1CN
InChIInChI=1S/C5H9N3S/c1-3-4(2-6)9-5(7)8-3/h2,6H2,1H3,(H2,7,8)
InChIKeyJQDANESPYFQIBF-UHFFFAOYSA-N
MW143.22 g/mol
LogP0.49
Rot. Bonds1

About 5-(aminomethyl)-4-methyl-1,3-thiazol-2-amine

5-(aminomethyl)-4-methyl-1,3-thiazol-2-amine (PubChem CID 24820452) has the molecular formula C5H9N3S and a molecular weight of 143.22 g/mol. Its IUPAC name is 5-(aminomethyl)-4-methyl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name5-(aminomethyl)-4-methyl-1,3-thiazol-2-amine
PubChem CID24820452
Molecular FormulaC5H9N3S
Molecular Weight143.22 g/mol
Exact Mass143.05
IUPAC Name5-(aminomethyl)-4-methyl-1,3-thiazol-2-amine
SMILESCc1nc(N)sc1CN
InChIInChI=1S/C5H9N3S/c1-3-4(2-6)9-5(7)8-3/h2,6H2,1H3,(H2,7,8)
InChIKeyJQDANESPYFQIBF-UHFFFAOYSA-N
XLogP0.49
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 ≤ 50.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(aminomethyl)-4-methyl-1,3-thiazol-2-amine?
The IUPAC name of 5-(aminomethyl)-4-methyl-1,3-thiazol-2-amine (CID 24820452) is 5-(aminomethyl)-4-methyl-1,3-thiazol-2-amine.
What is the SMILES notation for 5-(aminomethyl)-4-methyl-1,3-thiazol-2-amine?
The canonical SMILES for 5-(aminomethyl)-4-methyl-1,3-thiazol-2-amine is Cc1nc(N)sc1CN.
What is the InChIKey of 5-(aminomethyl)-4-methyl-1,3-thiazol-2-amine?
The InChIKey is JQDANESPYFQIBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9N3S/c1-3-4(2-6)9-5(7)8-3/h2,6H2,1H3,(H2,7,8).
What are the key properties of 5-(aminomethyl)-4-methyl-1,3-thiazol-2-amine?
5-(aminomethyl)-4-methyl-1,3-thiazol-2-amine has a molecular weight of 143.22 g/mol, XLogP of 0.49, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(aminomethyl)-4-methyl-1,3-thiazol-2-amine is sourced from PubChem (CID 24820452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).