N-[5-[[3-(fluoromethoxy)azetidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide

C10H14FN3O2S — CID 155121219

IUPACN-[5-[[3-(fluoromethoxy)azetidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide
SMILESCC(=O)Nc1ncc(CN2CC(OCF)C2)s1
InChIInChI=1S/C10H14FN3O2S/c1-7(15)13-10-12-2-9(17-10)5-14-3-8(4-14)16-6-11/h2,8H,3-6H2,1H3,(H,12,13,15)
InChIKeyFGOLTGVRZBAQGO-UHFFFAOYSA-N
MW259.31 g/mol
LogP1.23
Rot. Bonds5

About N-[5-[[3-(fluoromethoxy)azetidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide

N-[5-[[3-(fluoromethoxy)azetidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide (PubChem CID 155121219) has the molecular formula C10H14FN3O2S and a molecular weight of 259.31 g/mol. Its IUPAC name is N-[5-[[3-(fluoromethoxy)azetidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide.

Molecular Properties

Compound NameN-[5-[[3-(fluoromethoxy)azetidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide
PubChem CID155121219
Molecular FormulaC10H14FN3O2S
Molecular Weight259.31 g/mol
Exact Mass259.08
IUPAC NameN-[5-[[3-(fluoromethoxy)azetidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide
SMILESCC(=O)Nc1ncc(CN2CC(OCF)C2)s1
InChIInChI=1S/C10H14FN3O2S/c1-7(15)13-10-12-2-9(17-10)5-14-3-8(4-14)16-6-11/h2,8H,3-6H2,1H3,(H,12,13,15)
InChIKeyFGOLTGVRZBAQGO-UHFFFAOYSA-N
XLogP1.23
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[5-[[3-(fluoromethoxy)azetidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide?
The IUPAC name of N-[5-[[3-(fluoromethoxy)azetidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide (CID 155121219) is N-[5-[[3-(fluoromethoxy)azetidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide.
What is the SMILES notation for N-[5-[[3-(fluoromethoxy)azetidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide?
The canonical SMILES for N-[5-[[3-(fluoromethoxy)azetidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide is CC(=O)Nc1ncc(CN2CC(OCF)C2)s1.
What is the InChIKey of N-[5-[[3-(fluoromethoxy)azetidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide?
The InChIKey is FGOLTGVRZBAQGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14FN3O2S/c1-7(15)13-10-12-2-9(17-10)5-14-3-8(4-14)16-6-11/h2,8H,3-6H2,1H3,(H,12,13,15).
What are the key properties of N-[5-[[3-(fluoromethoxy)azetidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide?
N-[5-[[3-(fluoromethoxy)azetidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide has a molecular weight of 259.31 g/mol, XLogP of 1.23, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[[3-(fluoromethoxy)azetidin-1-yl]methyl]-1,3-thiazol-2-yl]acetamide is sourced from PubChem (CID 155121219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).