(1-methoxycyclopentyl)-(3-methyl-1,2-thiazol-5-yl)methanone

C11H15NO2S — CID 130695802

IUPAC(1-methoxycyclopentyl)-(3-methyl-1,2-thiazol-5-yl)methanone
SMILESCOC1(C(=O)c2cc(C)ns2)CCCC1
InChIInChI=1S/C11H15NO2S/c1-8-7-9(15-12-8)10(13)11(14-2)5-3-4-6-11/h7H,3-6H2,1-2H3
InChIKeyZUVSJLOSXVTEGN-UHFFFAOYSA-N
MW225.31 g/mol
LogP2.59
Rot. Bonds3

About (1-methoxycyclopentyl)-(3-methyl-1,2-thiazol-5-yl)methanone

(1-methoxycyclopentyl)-(3-methyl-1,2-thiazol-5-yl)methanone (PubChem CID 130695802) has the molecular formula C11H15NO2S and a molecular weight of 225.31 g/mol. Its IUPAC name is (1-methoxycyclopentyl)-(3-methyl-1,2-thiazol-5-yl)methanone.

Molecular Properties

Compound Name(1-methoxycyclopentyl)-(3-methyl-1,2-thiazol-5-yl)methanone
PubChem CID130695802
Molecular FormulaC11H15NO2S
Molecular Weight225.31 g/mol
Exact Mass225.08
IUPAC Name(1-methoxycyclopentyl)-(3-methyl-1,2-thiazol-5-yl)methanone
SMILESCOC1(C(=O)c2cc(C)ns2)CCCC1
InChIInChI=1S/C11H15NO2S/c1-8-7-9(15-12-8)10(13)11(14-2)5-3-4-6-11/h7H,3-6H2,1-2H3
InChIKeyZUVSJLOSXVTEGN-UHFFFAOYSA-N
XLogP2.59
TPSA39.19 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.31
LogP ≤ 52.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (1-methoxycyclopentyl)-(3-methyl-1,2-thiazol-5-yl)methanone?
The IUPAC name of (1-methoxycyclopentyl)-(3-methyl-1,2-thiazol-5-yl)methanone (CID 130695802) is (1-methoxycyclopentyl)-(3-methyl-1,2-thiazol-5-yl)methanone.
What is the SMILES notation for (1-methoxycyclopentyl)-(3-methyl-1,2-thiazol-5-yl)methanone?
The canonical SMILES for (1-methoxycyclopentyl)-(3-methyl-1,2-thiazol-5-yl)methanone is COC1(C(=O)c2cc(C)ns2)CCCC1.
What is the InChIKey of (1-methoxycyclopentyl)-(3-methyl-1,2-thiazol-5-yl)methanone?
The InChIKey is ZUVSJLOSXVTEGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO2S/c1-8-7-9(15-12-8)10(13)11(14-2)5-3-4-6-11/h7H,3-6H2,1-2H3.
What are the key properties of (1-methoxycyclopentyl)-(3-methyl-1,2-thiazol-5-yl)methanone?
(1-methoxycyclopentyl)-(3-methyl-1,2-thiazol-5-yl)methanone has a molecular weight of 225.31 g/mol, XLogP of 2.59, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methoxycyclopentyl)-(3-methyl-1,2-thiazol-5-yl)methanone is sourced from PubChem (CID 130695802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).