(6-cyclopentylsulfanyl-2-pyridinyl)methanol

C11H15NOS — CID 90118065

IUPAC(6-cyclopentylsulfanyl-2-pyridinyl)methanol
SMILESOCc1cccc(SC2CCCC2)n1
InChIInChI=1S/C11H15NOS/c13-8-9-4-3-7-11(12-9)14-10-5-1-2-6-10/h3-4,7,10,13H,1-2,5-6,8H2
InChIKeyGMBNRHPOIBPZEJ-UHFFFAOYSA-N
MW209.31 g/mol
LogP2.61
Rot. Bonds3

About (6-cyclopentylsulfanyl-2-pyridinyl)methanol

(6-cyclopentylsulfanyl-2-pyridinyl)methanol (PubChem CID 90118065) has the molecular formula C11H15NOS and a molecular weight of 209.31 g/mol. Its IUPAC name is (6-cyclopentylsulfanyl-2-pyridinyl)methanol.

Molecular Properties

Compound Name(6-cyclopentylsulfanyl-2-pyridinyl)methanol
PubChem CID90118065
Molecular FormulaC11H15NOS
Molecular Weight209.31 g/mol
Exact Mass209.09
IUPAC Name(6-cyclopentylsulfanyl-2-pyridinyl)methanol
SMILESOCc1cccc(SC2CCCC2)n1
InChIInChI=1S/C11H15NOS/c13-8-9-4-3-7-11(12-9)14-10-5-1-2-6-10/h3-4,7,10,13H,1-2,5-6,8H2
InChIKeyGMBNRHPOIBPZEJ-UHFFFAOYSA-N
XLogP2.61
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.31
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (6-cyclopentylsulfanyl-2-pyridinyl)methanol?
The IUPAC name of (6-cyclopentylsulfanyl-2-pyridinyl)methanol (CID 90118065) is (6-cyclopentylsulfanyl-2-pyridinyl)methanol.
What is the SMILES notation for (6-cyclopentylsulfanyl-2-pyridinyl)methanol?
The canonical SMILES for (6-cyclopentylsulfanyl-2-pyridinyl)methanol is OCc1cccc(SC2CCCC2)n1.
What is the InChIKey of (6-cyclopentylsulfanyl-2-pyridinyl)methanol?
The InChIKey is GMBNRHPOIBPZEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NOS/c13-8-9-4-3-7-11(12-9)14-10-5-1-2-6-10/h3-4,7,10,13H,1-2,5-6,8H2.
What are the key properties of (6-cyclopentylsulfanyl-2-pyridinyl)methanol?
(6-cyclopentylsulfanyl-2-pyridinyl)methanol has a molecular weight of 209.31 g/mol, XLogP of 2.61, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6-cyclopentylsulfanyl-2-pyridinyl)methanol is sourced from PubChem (CID 90118065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).