(2,4-dimethyl-1,3-thiazol-5-yl)methanamine;dihydrochloride

C6H12Cl2N2S — CID 46736898

IUPAC(2,4-dimethyl-1,3-thiazol-5-yl)methanamine;dihydrochloride
SMILESCc1nc(C)c(CN)s1.Cl.Cl
InChIInChI=1S/C6H10N2S.2ClH/c1-4-6(3-7)9-5(2)8-4;;/h3,7H2,1-2H3;2*1H
InChIKeyBAXJSYXKOHKTBE-UHFFFAOYSA-N
MW215.15 g/mol
LogP2.06
Rot. Bonds1

About (2,4-dimethyl-1,3-thiazol-5-yl)methanamine;dihydrochloride

(2,4-dimethyl-1,3-thiazol-5-yl)methanamine;dihydrochloride (PubChem CID 46736898) has the molecular formula C6H12Cl2N2S and a molecular weight of 215.15 g/mol. Its IUPAC name is (2,4-dimethyl-1,3-thiazol-5-yl)methanamine;dihydrochloride.

Molecular Properties

Compound Name(2,4-dimethyl-1,3-thiazol-5-yl)methanamine;dihydrochloride
PubChem CID46736898
Molecular FormulaC6H12Cl2N2S
Molecular Weight215.15 g/mol
Exact Mass214.01
IUPAC Name(2,4-dimethyl-1,3-thiazol-5-yl)methanamine;dihydrochloride
SMILESCc1nc(C)c(CN)s1.Cl.Cl
InChIInChI=1S/C6H10N2S.2ClH/c1-4-6(3-7)9-5(2)8-4;;/h3,7H2,1-2H3;2*1H
InChIKeyBAXJSYXKOHKTBE-UHFFFAOYSA-N
XLogP2.06
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.15
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (2,4-dimethyl-1,3-thiazol-5-yl)methanamine;dihydrochloride with MolForge

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

Launch Full Analysis

Related Compounds

1-(2,4-Dimethyl-1,3-thiazol-5-yl)ethan-1-amine
CID 19805509
(Dimethyl-1,3-thiazol-2-yl)methanamine
CID 24261647
1-(4,5-Dimethylthiazol-2-yl)ethanamine
CID 24261656
(4-Methyl-1,3-thiazol-5-yl)methanamine
CID 24688991
(Dimethyl-1,3-thiazol-5-yl)methanamine
CID 25219195
Methyl((4-methyl-1,3-thiazol-5-yl)methyl)amine
CID 28875446
(Dimethyl-1,3-thiazol-4-yl)methanamine
CID 69279054
1-(5-Methyl-1,3-thiazol-4-yl)methanamine hydrochloride
CID 91758822
2-(Dimethyl-1,3-thiazol-2-yl)ethan-1-amine
CID 9079481
[3-(4,5-Dimethyl-1,3-thiazol-2-YL)propyl]amine dihydrochloride
CID 50944269
4-Thiazolemethanamine, alpha,2,5-trimethyl-, hydrochloride (1:2)
CID 50944361
Methyl((4-methyl-2-propyl-1,3-thiazol-5-yl)methyl)amine
CID 62402846

Frequently Asked Questions

What is the IUPAC name of (2,4-dimethyl-1,3-thiazol-5-yl)methanamine;dihydrochloride?
The IUPAC name of (2,4-dimethyl-1,3-thiazol-5-yl)methanamine;dihydrochloride (CID 46736898) is (2,4-dimethyl-1,3-thiazol-5-yl)methanamine;dihydrochloride.
What is the SMILES notation for (2,4-dimethyl-1,3-thiazol-5-yl)methanamine;dihydrochloride?
The canonical SMILES for (2,4-dimethyl-1,3-thiazol-5-yl)methanamine;dihydrochloride is Cc1nc(C)c(CN)s1.Cl.Cl.
What is the InChIKey of (2,4-dimethyl-1,3-thiazol-5-yl)methanamine;dihydrochloride?
The InChIKey is BAXJSYXKOHKTBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2S.2ClH/c1-4-6(3-7)9-5(2)8-4;;/h3,7H2,1-2H3;2*1H.
What are the key properties of (2,4-dimethyl-1,3-thiazol-5-yl)methanamine;dihydrochloride?
(2,4-dimethyl-1,3-thiazol-5-yl)methanamine;dihydrochloride has a molecular weight of 215.15 g/mol, XLogP of 2.06, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2,4-dimethyl-1,3-thiazol-5-yl)methanamine;dihydrochloride is sourced from PubChem (CID 46736898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).