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

C8H11FN2OS — CID 126857875

IUPACN-(4-fluorooxolan-3-yl)-N-methyl-1,3-thiazol-2-amine
SMILESCN(c1nccs1)C1COCC1F
InChIInChI=1S/C8H11FN2OS/c1-11(8-10-2-3-13-8)7-5-12-4-6(7)9/h2-3,6-7H,4-5H2,1H3
InChIKeyWUXJKULOSNYUDL-UHFFFAOYSA-N
MW202.25 g/mol
LogP1.32
Rot. Bonds2

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

N-(4-fluorooxolan-3-yl)-N-methyl-1,3-thiazol-2-amine (PubChem CID 126857875) has the molecular formula C8H11FN2OS and a molecular weight of 202.25 g/mol. Its IUPAC name is N-(4-fluorooxolan-3-yl)-N-methyl-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-(4-fluorooxolan-3-yl)-N-methyl-1,3-thiazol-2-amine
PubChem CID126857875
Molecular FormulaC8H11FN2OS
Molecular Weight202.25 g/mol
Exact Mass202.06
IUPAC NameN-(4-fluorooxolan-3-yl)-N-methyl-1,3-thiazol-2-amine
SMILESCN(c1nccs1)C1COCC1F
InChIInChI=1S/C8H11FN2OS/c1-11(8-10-2-3-13-8)7-5-12-4-6(7)9/h2-3,6-7H,4-5H2,1H3
InChIKeyWUXJKULOSNYUDL-UHFFFAOYSA-N
XLogP1.32
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.25
LogP ≤ 51.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4-fluorooxolan-3-yl)-N-methyl-1,3-thiazol-2-amine?
The IUPAC name of N-(4-fluorooxolan-3-yl)-N-methyl-1,3-thiazol-2-amine (CID 126857875) is N-(4-fluorooxolan-3-yl)-N-methyl-1,3-thiazol-2-amine.
What is the SMILES notation for N-(4-fluorooxolan-3-yl)-N-methyl-1,3-thiazol-2-amine?
The canonical SMILES for N-(4-fluorooxolan-3-yl)-N-methyl-1,3-thiazol-2-amine is CN(c1nccs1)C1COCC1F.
What is the InChIKey of N-(4-fluorooxolan-3-yl)-N-methyl-1,3-thiazol-2-amine?
The InChIKey is WUXJKULOSNYUDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11FN2OS/c1-11(8-10-2-3-13-8)7-5-12-4-6(7)9/h2-3,6-7H,4-5H2,1H3.
What are the key properties of N-(4-fluorooxolan-3-yl)-N-methyl-1,3-thiazol-2-amine?
N-(4-fluorooxolan-3-yl)-N-methyl-1,3-thiazol-2-amine has a molecular weight of 202.25 g/mol, XLogP of 1.32, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorooxolan-3-yl)-N-methyl-1,3-thiazol-2-amine is sourced from PubChem (CID 126857875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).