5-(1,1-difluoroethyl)-4-methyl-1,3-thiazol-2-amine;hydrochloride

C6H9ClF2N2S — CID 84783642

IUPAC5-(1,1-difluoroethyl)-4-methyl-1,3-thiazol-2-amine;hydrochloride
SMILESCc1nc(N)sc1C(C)(F)F.Cl
InChIInChI=1S/C6H8F2N2S.ClH/c1-3-4(6(2,7)8)11-5(9)10-3;/h1-2H3,(H2,9,10);1H
InChIKeyPHRBSGZLCUQVTO-UHFFFAOYSA-N
MW214.67 g/mol
LogP2.57
Rot. Bonds1

About 5-(1,1-difluoroethyl)-4-methyl-1,3-thiazol-2-amine;hydrochloride

5-(1,1-difluoroethyl)-4-methyl-1,3-thiazol-2-amine;hydrochloride (PubChem CID 84783642) has the molecular formula C6H9ClF2N2S and a molecular weight of 214.67 g/mol. Its IUPAC name is 5-(1,1-difluoroethyl)-4-methyl-1,3-thiazol-2-amine;hydrochloride.

Molecular Properties

Compound Name5-(1,1-difluoroethyl)-4-methyl-1,3-thiazol-2-amine;hydrochloride
PubChem CID84783642
Molecular FormulaC6H9ClF2N2S
Molecular Weight214.67 g/mol
Exact Mass214.01
IUPAC Name5-(1,1-difluoroethyl)-4-methyl-1,3-thiazol-2-amine;hydrochloride
SMILESCc1nc(N)sc1C(C)(F)F.Cl
InChIInChI=1S/C6H8F2N2S.ClH/c1-3-4(6(2,7)8)11-5(9)10-3;/h1-2H3,(H2,9,10);1H
InChIKeyPHRBSGZLCUQVTO-UHFFFAOYSA-N
XLogP2.57
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.67
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-(1,1-difluoroethyl)-4-methyl-1,3-thiazol-2-amine;hydrochloride 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

5-(1,1-difluoroethyl)-4-phenyl-1,3-thiazol-2-amine
CID 83853866
5-(1,1,1,3,3,3-hexafluoropropan-2-yl)-4-methyl-1,3-thiazol-2-amine
CID 130154004
5-fluoro-4-methyl-1,3-thiazol-2-amine;hydrochloride
CID 71757840
1-[5-(1,1-difluoroethyl)-4-methyl-1,3-thiazol-2-yl]cyclopropan-1-amine
CID 84786147
4,5-dimethyl-1,3-thiazol-2-amine bromide
CID 21234862
4,5-ditert-butyl-1,3-thiazol-2-amine
CID 131164167
2-[5-(1,1-difluoroethyl)-4-methyl-1,3-thiazol-2-yl]propanoic acid
CID 84797299
2-amino-5-tert-butyl-1,3-thiazole-4-carbaldehyde
CID 84659689
5-(1,1-difluoroethyl)-4-methyl-2-pyrrolidin-3-yl-1,3-thiazole
CID 84795505
5-(1-tert-butylpyrazol-4-yl)-4-methyl-1,3-thiazol-2-amine
CID 169228380
5-(1-fluoroethyl)-4-methyl-1,3-thiazol-2-amine
CID 83853616
4-tert-butyl-1,3-thiazole-2,5-diamine
CID 82342196

Frequently Asked Questions

What is the IUPAC name of 5-(1,1-difluoroethyl)-4-methyl-1,3-thiazol-2-amine;hydrochloride?
The IUPAC name of 5-(1,1-difluoroethyl)-4-methyl-1,3-thiazol-2-amine;hydrochloride (CID 84783642) is 5-(1,1-difluoroethyl)-4-methyl-1,3-thiazol-2-amine;hydrochloride.
What is the SMILES notation for 5-(1,1-difluoroethyl)-4-methyl-1,3-thiazol-2-amine;hydrochloride?
The canonical SMILES for 5-(1,1-difluoroethyl)-4-methyl-1,3-thiazol-2-amine;hydrochloride is Cc1nc(N)sc1C(C)(F)F.Cl.
What is the InChIKey of 5-(1,1-difluoroethyl)-4-methyl-1,3-thiazol-2-amine;hydrochloride?
The InChIKey is PHRBSGZLCUQVTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8F2N2S.ClH/c1-3-4(6(2,7)8)11-5(9)10-3;/h1-2H3,(H2,9,10);1H.
What are the key properties of 5-(1,1-difluoroethyl)-4-methyl-1,3-thiazol-2-amine;hydrochloride?
5-(1,1-difluoroethyl)-4-methyl-1,3-thiazol-2-amine;hydrochloride has a molecular weight of 214.67 g/mol, XLogP of 2.57, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1,1-difluoroethyl)-4-methyl-1,3-thiazol-2-amine;hydrochloride is sourced from PubChem (CID 84783642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).