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

C5H9N3S — CID 21051220

IUPAC4-(aminomethyl)-N-methyl-1,3-thiazol-2-amine
SMILESCNc1nc(CN)cs1
InChIInChI=1S/C5H9N3S/c1-7-5-8-4(2-6)3-9-5/h3H,2,6H2,1H3,(H,7,8)
InChIKeyFJSMBHSKOJEYSY-UHFFFAOYSA-N
MW143.22 g/mol
LogP0.64
Rot. Bonds2

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

4-(aminomethyl)-N-methyl-1,3-thiazol-2-amine (PubChem CID 21051220) has the molecular formula C5H9N3S and a molecular weight of 143.22 g/mol. Its IUPAC name is 4-(aminomethyl)-N-methyl-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-(aminomethyl)-N-methyl-1,3-thiazol-2-amine
PubChem CID21051220
Molecular FormulaC5H9N3S
Molecular Weight143.22 g/mol
Exact Mass143.05
IUPAC Name4-(aminomethyl)-N-methyl-1,3-thiazol-2-amine
SMILESCNc1nc(CN)cs1
InChIInChI=1S/C5H9N3S/c1-7-5-8-4(2-6)3-9-5/h3H,2,6H2,1H3,(H,7,8)
InChIKeyFJSMBHSKOJEYSY-UHFFFAOYSA-N
XLogP0.64
TPSA50.94 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 ≤ 50.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-(aminomethyl)-N-methyl-1,3-thiazol-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(aminomethyl)-N-methyl-1,3-thiazol-2-amine?
The IUPAC name of 4-(aminomethyl)-N-methyl-1,3-thiazol-2-amine (CID 21051220) is 4-(aminomethyl)-N-methyl-1,3-thiazol-2-amine.
What is the SMILES notation for 4-(aminomethyl)-N-methyl-1,3-thiazol-2-amine?
The canonical SMILES for 4-(aminomethyl)-N-methyl-1,3-thiazol-2-amine is CNc1nc(CN)cs1.
What is the InChIKey of 4-(aminomethyl)-N-methyl-1,3-thiazol-2-amine?
The InChIKey is FJSMBHSKOJEYSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9N3S/c1-7-5-8-4(2-6)3-9-5/h3H,2,6H2,1H3,(H,7,8).
What are the key properties of 4-(aminomethyl)-N-methyl-1,3-thiazol-2-amine?
4-(aminomethyl)-N-methyl-1,3-thiazol-2-amine has a molecular weight of 143.22 g/mol, XLogP of 0.64, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(aminomethyl)-N-methyl-1,3-thiazol-2-amine is sourced from PubChem (CID 21051220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).