N-(2-fluoroethyl)-N-(2-methoxyethyl)-4-methyl-1,3-thiazol-2-amine

C9H15FN2OS — CID 88585181

IUPACN-(2-fluoroethyl)-N-(2-methoxyethyl)-4-methyl-1,3-thiazol-2-amine
SMILESCOCCN(CCF)c1nc(C)cs1
InChIInChI=1S/C9H15FN2OS/c1-8-7-14-9(11-8)12(4-3-10)5-6-13-2/h7H,3-6H2,1-2H3
InChIKeyIUIGIPCZWNOQIT-UHFFFAOYSA-N
MW218.30 g/mol
LogP1.87
Rot. Bonds6

About N-(2-fluoroethyl)-N-(2-methoxyethyl)-4-methyl-1,3-thiazol-2-amine

N-(2-fluoroethyl)-N-(2-methoxyethyl)-4-methyl-1,3-thiazol-2-amine (PubChem CID 88585181) has the molecular formula C9H15FN2OS and a molecular weight of 218.30 g/mol. Its IUPAC name is N-(2-fluoroethyl)-N-(2-methoxyethyl)-4-methyl-1,3-thiazol-2-amine.

Molecular Properties

Compound NameN-(2-fluoroethyl)-N-(2-methoxyethyl)-4-methyl-1,3-thiazol-2-amine
PubChem CID88585181
Molecular FormulaC9H15FN2OS
Molecular Weight218.30 g/mol
Exact Mass218.09
IUPAC NameN-(2-fluoroethyl)-N-(2-methoxyethyl)-4-methyl-1,3-thiazol-2-amine
SMILESCOCCN(CCF)c1nc(C)cs1
InChIInChI=1S/C9H15FN2OS/c1-8-7-14-9(11-8)12(4-3-10)5-6-13-2/h7H,3-6H2,1-2H3
InChIKeyIUIGIPCZWNOQIT-UHFFFAOYSA-N
XLogP1.87
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 51.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-fluoroethyl)-N-(2-methoxyethyl)-4-methyl-1,3-thiazol-2-amine?
The IUPAC name of N-(2-fluoroethyl)-N-(2-methoxyethyl)-4-methyl-1,3-thiazol-2-amine (CID 88585181) is N-(2-fluoroethyl)-N-(2-methoxyethyl)-4-methyl-1,3-thiazol-2-amine.
What is the SMILES notation for N-(2-fluoroethyl)-N-(2-methoxyethyl)-4-methyl-1,3-thiazol-2-amine?
The canonical SMILES for N-(2-fluoroethyl)-N-(2-methoxyethyl)-4-methyl-1,3-thiazol-2-amine is COCCN(CCF)c1nc(C)cs1.
What is the InChIKey of N-(2-fluoroethyl)-N-(2-methoxyethyl)-4-methyl-1,3-thiazol-2-amine?
The InChIKey is IUIGIPCZWNOQIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15FN2OS/c1-8-7-14-9(11-8)12(4-3-10)5-6-13-2/h7H,3-6H2,1-2H3.
What are the key properties of N-(2-fluoroethyl)-N-(2-methoxyethyl)-4-methyl-1,3-thiazol-2-amine?
N-(2-fluoroethyl)-N-(2-methoxyethyl)-4-methyl-1,3-thiazol-2-amine has a molecular weight of 218.30 g/mol, XLogP of 1.87, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoroethyl)-N-(2-methoxyethyl)-4-methyl-1,3-thiazol-2-amine is sourced from PubChem (CID 88585181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).