5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl(piperidin-3-yl)methanol

C12H18N2OS — CID 84736770

IUPAC5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl(piperidin-3-yl)methanol
SMILESOC(c1nc2c(s1)CCC2)C1CCCNC1
InChIInChI=1S/C12H18N2OS/c15-11(8-3-2-6-13-7-8)12-14-9-4-1-5-10(9)16-12/h8,11,13,15H,1-7H2
InChIKeyYWQLZMFUMKZFQV-UHFFFAOYSA-N
MW238.36 g/mol
LogP1.66
Rot. Bonds2

About 5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl(piperidin-3-yl)methanol

5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl(piperidin-3-yl)methanol (PubChem CID 84736770) has the molecular formula C12H18N2OS and a molecular weight of 238.36 g/mol. Its IUPAC name is 5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl(piperidin-3-yl)methanol.

Molecular Properties

Compound Name5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl(piperidin-3-yl)methanol
PubChem CID84736770
Molecular FormulaC12H18N2OS
Molecular Weight238.36 g/mol
Exact Mass238.11
IUPAC Name5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl(piperidin-3-yl)methanol
SMILESOC(c1nc2c(s1)CCC2)C1CCCNC1
InChIInChI=1S/C12H18N2OS/c15-11(8-3-2-6-13-7-8)12-14-9-4-1-5-10(9)16-12/h8,11,13,15H,1-7H2
InChIKeyYWQLZMFUMKZFQV-UHFFFAOYSA-N
XLogP1.66
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.36
LogP ≤ 51.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl(piperidin-3-yl)methanol?
The IUPAC name of 5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl(piperidin-3-yl)methanol (CID 84736770) is 5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl(piperidin-3-yl)methanol.
What is the SMILES notation for 5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl(piperidin-3-yl)methanol?
The canonical SMILES for 5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl(piperidin-3-yl)methanol is OC(c1nc2c(s1)CCC2)C1CCCNC1.
What is the InChIKey of 5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl(piperidin-3-yl)methanol?
The InChIKey is YWQLZMFUMKZFQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2OS/c15-11(8-3-2-6-13-7-8)12-14-9-4-1-5-10(9)16-12/h8,11,13,15H,1-7H2.
What are the key properties of 5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl(piperidin-3-yl)methanol?
5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl(piperidin-3-yl)methanol has a molecular weight of 238.36 g/mol, XLogP of 1.66, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dihydro-4H-cyclopenta[d][1,3]thiazol-2-yl(piperidin-3-yl)methanol is sourced from PubChem (CID 84736770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).