N,2-dimethyl-1,3-thiazol-4-amine;dihydrochloride

C5H10Cl2N2S — CID 172751463

IUPACN,2-dimethyl-1,3-thiazol-4-amine;dihydrochloride
SMILESCNc1csc(C)n1.Cl.Cl
InChIInChI=1S/C5H8N2S.2ClH/c1-4-7-5(6-2)3-8-4;;/h3,6H,1-2H3;2*1H
InChIKeyKKWVAMRXPMDRPC-UHFFFAOYSA-N
MW201.12 g/mol
LogP2.34
Rot. Bonds1

About N,2-dimethyl-1,3-thiazol-4-amine;dihydrochloride

N,2-dimethyl-1,3-thiazol-4-amine;dihydrochloride (PubChem CID 172751463) has the molecular formula C5H10Cl2N2S and a molecular weight of 201.12 g/mol. Its IUPAC name is N,2-dimethyl-1,3-thiazol-4-amine;dihydrochloride.

Molecular Properties

Compound NameN,2-dimethyl-1,3-thiazol-4-amine;dihydrochloride
PubChem CID172751463
Molecular FormulaC5H10Cl2N2S
Molecular Weight201.12 g/mol
Exact Mass199.99
IUPAC NameN,2-dimethyl-1,3-thiazol-4-amine;dihydrochloride
SMILESCNc1csc(C)n1.Cl.Cl
InChIInChI=1S/C5H8N2S.2ClH/c1-4-7-5(6-2)3-8-4;;/h3,6H,1-2H3;2*1H
InChIKeyKKWVAMRXPMDRPC-UHFFFAOYSA-N
XLogP2.34
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.12
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-1,3-thiazol-4-amine;dihydrochloride?
The IUPAC name of N,2-dimethyl-1,3-thiazol-4-amine;dihydrochloride (CID 172751463) is N,2-dimethyl-1,3-thiazol-4-amine;dihydrochloride.
What is the SMILES notation for N,2-dimethyl-1,3-thiazol-4-amine;dihydrochloride?
The canonical SMILES for N,2-dimethyl-1,3-thiazol-4-amine;dihydrochloride is CNc1csc(C)n1.Cl.Cl.
What is the InChIKey of N,2-dimethyl-1,3-thiazol-4-amine;dihydrochloride?
The InChIKey is KKWVAMRXPMDRPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N2S.2ClH/c1-4-7-5(6-2)3-8-4;;/h3,6H,1-2H3;2*1H.
What are the key properties of N,2-dimethyl-1,3-thiazol-4-amine;dihydrochloride?
N,2-dimethyl-1,3-thiazol-4-amine;dihydrochloride has a molecular weight of 201.12 g/mol, XLogP of 2.34, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-1,3-thiazol-4-amine;dihydrochloride is sourced from PubChem (CID 172751463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).