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

C5H9N3S — CID 67482223

IUPAC2-(aminomethyl)-N-methyl-1,3-thiazol-4-amine
SMILESCNc1csc(CN)n1
InChIInChI=1S/C5H9N3S/c1-7-4-3-9-5(2-6)8-4/h3,7H,2,6H2,1H3
InChIKeyQEUXLSNCILQSTK-UHFFFAOYSA-N
MW143.22 g/mol
LogP0.64
Rot. Bonds2

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

2-(aminomethyl)-N-methyl-1,3-thiazol-4-amine (PubChem CID 67482223) has the molecular formula C5H9N3S and a molecular weight of 143.22 g/mol. Its IUPAC name is 2-(aminomethyl)-N-methyl-1,3-thiazol-4-amine.

Molecular Properties

Compound Name2-(aminomethyl)-N-methyl-1,3-thiazol-4-amine
PubChem CID67482223
Molecular FormulaC5H9N3S
Molecular Weight143.22 g/mol
Exact Mass143.05
IUPAC Name2-(aminomethyl)-N-methyl-1,3-thiazol-4-amine
SMILESCNc1csc(CN)n1
InChIInChI=1S/C5H9N3S/c1-7-4-3-9-5(2-6)8-4/h3,7H,2,6H2,1H3
InChIKeyQEUXLSNCILQSTK-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

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Frequently Asked Questions

What is the IUPAC name of 2-(aminomethyl)-N-methyl-1,3-thiazol-4-amine?
The IUPAC name of 2-(aminomethyl)-N-methyl-1,3-thiazol-4-amine (CID 67482223) is 2-(aminomethyl)-N-methyl-1,3-thiazol-4-amine.
What is the SMILES notation for 2-(aminomethyl)-N-methyl-1,3-thiazol-4-amine?
The canonical SMILES for 2-(aminomethyl)-N-methyl-1,3-thiazol-4-amine is CNc1csc(CN)n1.
What is the InChIKey of 2-(aminomethyl)-N-methyl-1,3-thiazol-4-amine?
The InChIKey is QEUXLSNCILQSTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9N3S/c1-7-4-3-9-5(2-6)8-4/h3,7H,2,6H2,1H3.
What are the key properties of 2-(aminomethyl)-N-methyl-1,3-thiazol-4-amine?
2-(aminomethyl)-N-methyl-1,3-thiazol-4-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 2-(aminomethyl)-N-methyl-1,3-thiazol-4-amine is sourced from PubChem (CID 67482223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).