N-(4-fluorophenyl)-4,5-dihydro-1,3-thiazol-2-amine;hydrochloride

C9H10ClFN2S — CID 24846782

IUPACN-(4-fluorophenyl)-4,5-dihydro-1,3-thiazol-2-amine;hydrochloride
SMILESCl.Fc1ccc(NC2=NCCS2)cc1
InChIInChI=1S/C9H9FN2S.ClH/c10-7-1-3-8(4-2-7)12-9-11-5-6-13-9;/h1-4H,5-6H2,(H,11,12);1H
InChIKeyZUFNFYMBMHJEQP-UHFFFAOYSA-N
MW232.71 g/mol
LogP2.76
Rot. Bonds1

About N-(4-fluorophenyl)-4,5-dihydro-1,3-thiazol-2-amine;hydrochloride

N-(4-fluorophenyl)-4,5-dihydro-1,3-thiazol-2-amine;hydrochloride (PubChem CID 24846782) has the molecular formula C9H10ClFN2S and a molecular weight of 232.71 g/mol. Its IUPAC name is N-(4-fluorophenyl)-4,5-dihydro-1,3-thiazol-2-amine;hydrochloride.

Molecular Properties

Compound NameN-(4-fluorophenyl)-4,5-dihydro-1,3-thiazol-2-amine;hydrochloride
PubChem CID24846782
Molecular FormulaC9H10ClFN2S
Molecular Weight232.71 g/mol
Exact Mass232.02
IUPAC NameN-(4-fluorophenyl)-4,5-dihydro-1,3-thiazol-2-amine;hydrochloride
SMILESCl.Fc1ccc(NC2=NCCS2)cc1
InChIInChI=1S/C9H9FN2S.ClH/c10-7-1-3-8(4-2-7)12-9-11-5-6-13-9;/h1-4H,5-6H2,(H,11,12);1H
InChIKeyZUFNFYMBMHJEQP-UHFFFAOYSA-N
XLogP2.76
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.71
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-methylphenyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 7303198
N-(3,4-difluorophenyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 29068216
N-[[4-(4,5-dihydro-1,3-thiazol-2-ylamino)phenyl]methyl]-4,5-dihydro-1,3-thiazol-2-amine
CID 139763051
N-(2,5-difluorophenyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 29068132
N-(4-methoxyphenyl)-4,5-dihydro-1,3-thiazol-2-amine bromide
CID 21179407
N-(4-morpholin-4-ylphenyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 2731411
N-(4-butylsulfanylphenyl)-4,5-dihydro-1,3-thiazol-2-amine;hydrochloride
CID 24846776
N-(4-chlorophenyl)-5,6-dihydro-4H-1,3-thiazin-2-amine
CID 14391638
4-N-(5,6-dihydro-4H-1,3-thiazin-2-yl)-1-N-phenylbenzene-1,4-diamine
CID 17338742
N-(1,3-benzodioxol-5-yl)-4,5-dihydro-1,3-thiazol-2-amine
CID 29068023
N-(4-bromo-3-chlorophenyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 107614115
N-pyridin-3-yl-4,5-dihydro-1,3-thiazol-2-amine
CID 5169811

Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-4,5-dihydro-1,3-thiazol-2-amine;hydrochloride?
The IUPAC name of N-(4-fluorophenyl)-4,5-dihydro-1,3-thiazol-2-amine;hydrochloride (CID 24846782) is N-(4-fluorophenyl)-4,5-dihydro-1,3-thiazol-2-amine;hydrochloride.
What is the SMILES notation for N-(4-fluorophenyl)-4,5-dihydro-1,3-thiazol-2-amine;hydrochloride?
The canonical SMILES for N-(4-fluorophenyl)-4,5-dihydro-1,3-thiazol-2-amine;hydrochloride is Cl.Fc1ccc(NC2=NCCS2)cc1.
What is the InChIKey of N-(4-fluorophenyl)-4,5-dihydro-1,3-thiazol-2-amine;hydrochloride?
The InChIKey is ZUFNFYMBMHJEQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9FN2S.ClH/c10-7-1-3-8(4-2-7)12-9-11-5-6-13-9;/h1-4H,5-6H2,(H,11,12);1H.
What are the key properties of N-(4-fluorophenyl)-4,5-dihydro-1,3-thiazol-2-amine;hydrochloride?
N-(4-fluorophenyl)-4,5-dihydro-1,3-thiazol-2-amine;hydrochloride has a molecular weight of 232.71 g/mol, XLogP of 2.76, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-4,5-dihydro-1,3-thiazol-2-amine;hydrochloride is sourced from PubChem (CID 24846782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).