N-methyl-1,3-thiazol-2-amine

C4H6N2S — CID 11959081

IUPACN-methyl-1,3-thiazol-2-amine
SMILESCNc1nccs1
InChIInChI=1S/C4H6N2S/c1-5-4-6-2-3-7-4/h2-3H,1H3,(H,5,6)
InChIKeyDWVCPSQPTSNMRX-UHFFFAOYSA-N
MW114.17 g/mol
LogP1.18
Rot. Bonds1

About N-methyl-1,3-thiazol-2-amine

N-methyl-1,3-thiazol-2-amine (PubChem CID 11959081) has the molecular formula C4H6N2S and a molecular weight of 114.17 g/mol. Its IUPAC name is N-methyl-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-methyl-1,3-thiazol-2-amine
PubChem CID11959081
Molecular FormulaC4H6N2S
Molecular Weight114.17 g/mol
Exact Mass114.03
IUPAC NameN-methyl-1,3-thiazol-2-amine
SMILESCNc1nccs1
InChIInChI=1S/C4H6N2S/c1-5-4-6-2-3-7-4/h2-3H,1H3,(H,5,6)
InChIKeyDWVCPSQPTSNMRX-UHFFFAOYSA-N
XLogP1.18
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.17
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1,3-thiazol-2-amine?
The IUPAC name of N-methyl-1,3-thiazol-2-amine (CID 11959081) is N-methyl-1,3-thiazol-2-amine.
What is the SMILES notation for N-methyl-1,3-thiazol-2-amine?
The canonical SMILES for N-methyl-1,3-thiazol-2-amine is CNc1nccs1.
What is the InChIKey of N-methyl-1,3-thiazol-2-amine?
The InChIKey is DWVCPSQPTSNMRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H6N2S/c1-5-4-6-2-3-7-4/h2-3H,1H3,(H,5,6).
What are the key properties of N-methyl-1,3-thiazol-2-amine?
N-methyl-1,3-thiazol-2-amine has a molecular weight of 114.17 g/mol, XLogP of 1.18, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1,3-thiazol-2-amine is sourced from PubChem (CID 11959081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).