1-[5-(2-fluoropropan-2-yl)-4-methyl-1,3-thiazol-2-yl]cyclopropan-1-ol

C10H14FNOS — CID 84784046

IUPAC1-[5-(2-fluoropropan-2-yl)-4-methyl-1,3-thiazol-2-yl]cyclopropan-1-ol
SMILESCc1nc(C2(O)CC2)sc1C(C)(C)F
InChIInChI=1S/C10H14FNOS/c1-6-7(9(2,3)11)14-8(12-6)10(13)4-5-10/h13H,4-5H2,1-3H3
InChIKeyNIIIHVJJANTNLL-UHFFFAOYSA-N
MW215.29 g/mol
LogP2.64
Rot. Bonds2

About 1-[5-(2-fluoropropan-2-yl)-4-methyl-1,3-thiazol-2-yl]cyclopropan-1-ol

1-[5-(2-fluoropropan-2-yl)-4-methyl-1,3-thiazol-2-yl]cyclopropan-1-ol (PubChem CID 84784046) has the molecular formula C10H14FNOS and a molecular weight of 215.29 g/mol. Its IUPAC name is 1-[5-(2-fluoropropan-2-yl)-4-methyl-1,3-thiazol-2-yl]cyclopropan-1-ol.

Molecular Properties

Compound Name1-[5-(2-fluoropropan-2-yl)-4-methyl-1,3-thiazol-2-yl]cyclopropan-1-ol
PubChem CID84784046
Molecular FormulaC10H14FNOS
Molecular Weight215.29 g/mol
Exact Mass215.08
IUPAC Name1-[5-(2-fluoropropan-2-yl)-4-methyl-1,3-thiazol-2-yl]cyclopropan-1-ol
SMILESCc1nc(C2(O)CC2)sc1C(C)(C)F
InChIInChI=1S/C10H14FNOS/c1-6-7(9(2,3)11)14-8(12-6)10(13)4-5-10/h13H,4-5H2,1-3H3
InChIKeyNIIIHVJJANTNLL-UHFFFAOYSA-N
XLogP2.64
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.29
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[5-(2-fluoropropan-2-yl)-4-methyl-1,3-thiazol-2-yl]cyclopropan-1-ol?
The IUPAC name of 1-[5-(2-fluoropropan-2-yl)-4-methyl-1,3-thiazol-2-yl]cyclopropan-1-ol (CID 84784046) is 1-[5-(2-fluoropropan-2-yl)-4-methyl-1,3-thiazol-2-yl]cyclopropan-1-ol.
What is the SMILES notation for 1-[5-(2-fluoropropan-2-yl)-4-methyl-1,3-thiazol-2-yl]cyclopropan-1-ol?
The canonical SMILES for 1-[5-(2-fluoropropan-2-yl)-4-methyl-1,3-thiazol-2-yl]cyclopropan-1-ol is Cc1nc(C2(O)CC2)sc1C(C)(C)F.
What is the InChIKey of 1-[5-(2-fluoropropan-2-yl)-4-methyl-1,3-thiazol-2-yl]cyclopropan-1-ol?
The InChIKey is NIIIHVJJANTNLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14FNOS/c1-6-7(9(2,3)11)14-8(12-6)10(13)4-5-10/h13H,4-5H2,1-3H3.
What are the key properties of 1-[5-(2-fluoropropan-2-yl)-4-methyl-1,3-thiazol-2-yl]cyclopropan-1-ol?
1-[5-(2-fluoropropan-2-yl)-4-methyl-1,3-thiazol-2-yl]cyclopropan-1-ol has a molecular weight of 215.29 g/mol, XLogP of 2.64, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(2-fluoropropan-2-yl)-4-methyl-1,3-thiazol-2-yl]cyclopropan-1-ol is sourced from PubChem (CID 84784046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).