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

C10H11FN2S — CID 2729140

IUPACN-(2-fluorophenyl)-5-methyl-4,5-dihydro-1,3-thiazol-2-amine
SMILESCC1CN=C(Nc2ccccc2F)S1
InChIInChI=1S/C10H11FN2S/c1-7-6-12-10(14-7)13-9-5-3-2-4-8(9)11/h2-5,7H,6H2,1H3,(H,12,13)
InChIKeyWAORFBXSARWMHX-UHFFFAOYSA-N
MW210.28 g/mol
LogP2.73
Rot. Bonds1

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

N-(2-fluorophenyl)-5-methyl-4,5-dihydro-1,3-thiazol-2-amine (PubChem CID 2729140) has the molecular formula C10H11FN2S and a molecular weight of 210.28 g/mol. Its IUPAC name is N-(2-fluorophenyl)-5-methyl-4,5-dihydro-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-(2-fluorophenyl)-5-methyl-4,5-dihydro-1,3-thiazol-2-amine
PubChem CID2729140
Molecular FormulaC10H11FN2S
Molecular Weight210.28 g/mol
Exact Mass210.06
IUPAC NameN-(2-fluorophenyl)-5-methyl-4,5-dihydro-1,3-thiazol-2-amine
SMILESCC1CN=C(Nc2ccccc2F)S1
InChIInChI=1S/C10H11FN2S/c1-7-6-12-10(14-7)13-9-5-3-2-4-8(9)11/h2-5,7H,6H2,1H3,(H,12,13)
InChIKeyWAORFBXSARWMHX-UHFFFAOYSA-N
XLogP2.73
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-fluorophenyl)-5-methyl-4,5-dihydro-1,3-thiazol-2-amine?
The IUPAC name of N-(2-fluorophenyl)-5-methyl-4,5-dihydro-1,3-thiazol-2-amine (CID 2729140) is N-(2-fluorophenyl)-5-methyl-4,5-dihydro-1,3-thiazol-2-amine.
What is the SMILES notation for N-(2-fluorophenyl)-5-methyl-4,5-dihydro-1,3-thiazol-2-amine?
The canonical SMILES for N-(2-fluorophenyl)-5-methyl-4,5-dihydro-1,3-thiazol-2-amine is CC1CN=C(Nc2ccccc2F)S1.
What is the InChIKey of N-(2-fluorophenyl)-5-methyl-4,5-dihydro-1,3-thiazol-2-amine?
The InChIKey is WAORFBXSARWMHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11FN2S/c1-7-6-12-10(14-7)13-9-5-3-2-4-8(9)11/h2-5,7H,6H2,1H3,(H,12,13).
What are the key properties of N-(2-fluorophenyl)-5-methyl-4,5-dihydro-1,3-thiazol-2-amine?
N-(2-fluorophenyl)-5-methyl-4,5-dihydro-1,3-thiazol-2-amine has a molecular weight of 210.28 g/mol, XLogP of 2.73, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluorophenyl)-5-methyl-4,5-dihydro-1,3-thiazol-2-amine is sourced from PubChem (CID 2729140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).