4-(3-fluorophenyl)-6H-1,3-thiazin-2-amine

C10H9FN2S — CID 175695807

IUPAC4-(3-fluorophenyl)-6H-1,3-thiazin-2-amine
SMILESNC1=NC(c2cccc(F)c2)=CCS1
InChIInChI=1S/C10H9FN2S/c11-8-3-1-2-7(6-8)9-4-5-14-10(12)13-9/h1-4,6H,5H2,(H2,12,13)
InChIKeyVMPRISXPPOLNNI-UHFFFAOYSA-N
MW208.26 g/mol
LogP2.23
Rot. Bonds1

About 4-(3-fluorophenyl)-6H-1,3-thiazin-2-amine

4-(3-fluorophenyl)-6H-1,3-thiazin-2-amine (PubChem CID 175695807) has the molecular formula C10H9FN2S and a molecular weight of 208.26 g/mol. Its IUPAC name is 4-(3-fluorophenyl)-6H-1,3-thiazin-2-amine.

Molecular Properties

Compound Name4-(3-fluorophenyl)-6H-1,3-thiazin-2-amine
PubChem CID175695807
Molecular FormulaC10H9FN2S
Molecular Weight208.26 g/mol
Exact Mass208.05
IUPAC Name4-(3-fluorophenyl)-6H-1,3-thiazin-2-amine
SMILESNC1=NC(c2cccc(F)c2)=CCS1
InChIInChI=1S/C10H9FN2S/c11-8-3-1-2-7(6-8)9-4-5-14-10(12)13-9/h1-4,6H,5H2,(H2,12,13)
InChIKeyVMPRISXPPOLNNI-UHFFFAOYSA-N
XLogP2.23
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(3-fluorophenyl)-6H-1,3-thiazin-2-amine?
The IUPAC name of 4-(3-fluorophenyl)-6H-1,3-thiazin-2-amine (CID 175695807) is 4-(3-fluorophenyl)-6H-1,3-thiazin-2-amine.
What is the SMILES notation for 4-(3-fluorophenyl)-6H-1,3-thiazin-2-amine?
The canonical SMILES for 4-(3-fluorophenyl)-6H-1,3-thiazin-2-amine is NC1=NC(c2cccc(F)c2)=CCS1.
What is the InChIKey of 4-(3-fluorophenyl)-6H-1,3-thiazin-2-amine?
The InChIKey is VMPRISXPPOLNNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9FN2S/c11-8-3-1-2-7(6-8)9-4-5-14-10(12)13-9/h1-4,6H,5H2,(H2,12,13).
What are the key properties of 4-(3-fluorophenyl)-6H-1,3-thiazin-2-amine?
4-(3-fluorophenyl)-6H-1,3-thiazin-2-amine has a molecular weight of 208.26 g/mol, XLogP of 2.23, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-fluorophenyl)-6H-1,3-thiazin-2-amine is sourced from PubChem (CID 175695807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).