N-(4-fluoronaphthalen-1-yl)-1,3-thiazol-2-amine

C13H9FN2S — CID 91534267

IUPACN-(4-fluoronaphthalen-1-yl)-1,3-thiazol-2-amine
SMILESFc1ccc(Nc2nccs2)c2ccccc12
InChIInChI=1S/C13H9FN2S/c14-11-5-6-12(16-13-15-7-8-17-13)10-4-2-1-3-9(10)11/h1-8H,(H,15,16)
InChIKeyKRGZRTXSIZOPTJ-UHFFFAOYSA-N
MW244.29 g/mol
LogP4.18
Rot. Bonds2

About N-(4-fluoronaphthalen-1-yl)-1,3-thiazol-2-amine

N-(4-fluoronaphthalen-1-yl)-1,3-thiazol-2-amine (PubChem CID 91534267) has the molecular formula C13H9FN2S and a molecular weight of 244.29 g/mol. Its IUPAC name is N-(4-fluoronaphthalen-1-yl)-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-(4-fluoronaphthalen-1-yl)-1,3-thiazol-2-amine
PubChem CID91534267
Molecular FormulaC13H9FN2S
Molecular Weight244.29 g/mol
Exact Mass244.05
IUPAC NameN-(4-fluoronaphthalen-1-yl)-1,3-thiazol-2-amine
SMILESFc1ccc(Nc2nccs2)c2ccccc12
InChIInChI=1S/C13H9FN2S/c14-11-5-6-12(16-13-15-7-8-17-13)10-4-2-1-3-9(10)11/h1-8H,(H,15,16)
InChIKeyKRGZRTXSIZOPTJ-UHFFFAOYSA-N
XLogP4.18
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-fluorophenyl)-1,3-thiazol-2-amine
CID 82537266
1-N-pyrimidin-2-yl-2-N-(1,3-thiazol-2-yl)benzene-1,2-diamine
CID 123214519
N-(4-fluoronaphthalen-1-yl)-1,3-thiazol-4-amine
CID 68802600
N-[5-(6-methyl-2-pyridinyl)quinolin-6-yl]-1,3-thiazol-2-amine
CID 90742822
N-(3-fluoro-4-methylphenyl)-1,3-thiazol-2-amine
CID 87538093
N-(3-chlorophenyl)-4-fluoronaphthalen-1-amine
CID 69169805
N-(5-methyl-1-phenylpyrazol-4-yl)-1,3-thiazol-2-amine
CID 90988497
6-N-naphthalen-1-yl-5-nitro-4-N-(1,3-thiazol-2-yl)pyrimidine-4,6-diamine
CID 22527520
1,1-dioxo-N-(1,3-thiazol-2-yl)-1,2-benzothiazol-3-amine
CID 4770387
N-[4-(4-chlorophenyl)sulfanylphenyl]-1,3-thiazol-2-amine
CID 87964045
N-(naphthalen-1-ylmethyl)-1,3-thiazol-2-amine
CID 4711877
N-[1-(2-fluorophenyl)propyl]-1,3-thiazol-2-amine
CID 112677046

Frequently Asked Questions

What is the IUPAC name of N-(4-fluoronaphthalen-1-yl)-1,3-thiazol-2-amine?
The IUPAC name of N-(4-fluoronaphthalen-1-yl)-1,3-thiazol-2-amine (CID 91534267) is N-(4-fluoronaphthalen-1-yl)-1,3-thiazol-2-amine.
What is the SMILES notation for N-(4-fluoronaphthalen-1-yl)-1,3-thiazol-2-amine?
The canonical SMILES for N-(4-fluoronaphthalen-1-yl)-1,3-thiazol-2-amine is Fc1ccc(Nc2nccs2)c2ccccc12.
What is the InChIKey of N-(4-fluoronaphthalen-1-yl)-1,3-thiazol-2-amine?
The InChIKey is KRGZRTXSIZOPTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9FN2S/c14-11-5-6-12(16-13-15-7-8-17-13)10-4-2-1-3-9(10)11/h1-8H,(H,15,16).
What are the key properties of N-(4-fluoronaphthalen-1-yl)-1,3-thiazol-2-amine?
N-(4-fluoronaphthalen-1-yl)-1,3-thiazol-2-amine has a molecular weight of 244.29 g/mol, XLogP of 4.18, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluoronaphthalen-1-yl)-1,3-thiazol-2-amine is sourced from PubChem (CID 91534267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).