[2-[[1-(3-fluoropropyl)azetidin-3-yl]methyl]-1,3-thiazol-5-yl]methanol

C11H17FN2OS — CID 170950808

IUPAC[2-[[1-(3-fluoropropyl)azetidin-3-yl]methyl]-1,3-thiazol-5-yl]methanol
SMILESOCc1cnc(CC2CN(CCCF)C2)s1
InChIInChI=1S/C11H17FN2OS/c12-2-1-3-14-6-9(7-14)4-11-13-5-10(8-15)16-11/h5,9,15H,1-4,6-8H2
InChIKeyRFSVFFGQSMUSRM-UHFFFAOYSA-N
MW244.33 g/mol
LogP1.47
Rot. Bonds6

About [2-[[1-(3-fluoropropyl)azetidin-3-yl]methyl]-1,3-thiazol-5-yl]methanol

[2-[[1-(3-fluoropropyl)azetidin-3-yl]methyl]-1,3-thiazol-5-yl]methanol (PubChem CID 170950808) has the molecular formula C11H17FN2OS and a molecular weight of 244.33 g/mol. Its IUPAC name is [2-[[1-(3-fluoropropyl)azetidin-3-yl]methyl]-1,3-thiazol-5-yl]methanol.

Molecular Properties

Compound Name[2-[[1-(3-fluoropropyl)azetidin-3-yl]methyl]-1,3-thiazol-5-yl]methanol
PubChem CID170950808
Molecular FormulaC11H17FN2OS
Molecular Weight244.33 g/mol
Exact Mass244.10
IUPAC Name[2-[[1-(3-fluoropropyl)azetidin-3-yl]methyl]-1,3-thiazol-5-yl]methanol
SMILESOCc1cnc(CC2CN(CCCF)C2)s1
InChIInChI=1S/C11H17FN2OS/c12-2-1-3-14-6-9(7-14)4-11-13-5-10(8-15)16-11/h5,9,15H,1-4,6-8H2
InChIKeyRFSVFFGQSMUSRM-UHFFFAOYSA-N
XLogP1.47
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.33
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [2-[[1-(3-fluoropropyl)azetidin-3-yl]methyl]-1,3-thiazol-5-yl]methanol?
The IUPAC name of [2-[[1-(3-fluoropropyl)azetidin-3-yl]methyl]-1,3-thiazol-5-yl]methanol (CID 170950808) is [2-[[1-(3-fluoropropyl)azetidin-3-yl]methyl]-1,3-thiazol-5-yl]methanol.
What is the SMILES notation for [2-[[1-(3-fluoropropyl)azetidin-3-yl]methyl]-1,3-thiazol-5-yl]methanol?
The canonical SMILES for [2-[[1-(3-fluoropropyl)azetidin-3-yl]methyl]-1,3-thiazol-5-yl]methanol is OCc1cnc(CC2CN(CCCF)C2)s1.
What is the InChIKey of [2-[[1-(3-fluoropropyl)azetidin-3-yl]methyl]-1,3-thiazol-5-yl]methanol?
The InChIKey is RFSVFFGQSMUSRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17FN2OS/c12-2-1-3-14-6-9(7-14)4-11-13-5-10(8-15)16-11/h5,9,15H,1-4,6-8H2.
What are the key properties of [2-[[1-(3-fluoropropyl)azetidin-3-yl]methyl]-1,3-thiazol-5-yl]methanol?
[2-[[1-(3-fluoropropyl)azetidin-3-yl]methyl]-1,3-thiazol-5-yl]methanol has a molecular weight of 244.33 g/mol, XLogP of 1.47, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[[1-(3-fluoropropyl)azetidin-3-yl]methyl]-1,3-thiazol-5-yl]methanol is sourced from PubChem (CID 170950808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).