4-(4-methylthiophen-2-yl)piperidin-4-ol;hydrochloride

C10H16ClNOS — CID 67869406

IUPAC4-(4-methylthiophen-2-yl)piperidin-4-ol;hydrochloride
SMILESCc1csc(C2(O)CCNCC2)c1.Cl
InChIInChI=1S/C10H15NOS.ClH/c1-8-6-9(13-7-8)10(12)2-4-11-5-3-10;/h6-7,11-12H,2-5H2,1H3;1H
InChIKeyUNTOPRWREQFUTH-UHFFFAOYSA-N
MW233.76 g/mol
LogP2.05
Rot. Bonds1

About 4-(4-methylthiophen-2-yl)piperidin-4-ol;hydrochloride

4-(4-methylthiophen-2-yl)piperidin-4-ol;hydrochloride (PubChem CID 67869406) has the molecular formula C10H16ClNOS and a molecular weight of 233.76 g/mol. Its IUPAC name is 4-(4-methylthiophen-2-yl)piperidin-4-ol;hydrochloride.

Molecular Properties

Compound Name4-(4-methylthiophen-2-yl)piperidin-4-ol;hydrochloride
PubChem CID67869406
Molecular FormulaC10H16ClNOS
Molecular Weight233.76 g/mol
Exact Mass233.06
IUPAC Name4-(4-methylthiophen-2-yl)piperidin-4-ol;hydrochloride
SMILESCc1csc(C2(O)CCNCC2)c1.Cl
InChIInChI=1S/C10H15NOS.ClH/c1-8-6-9(13-7-8)10(12)2-4-11-5-3-10;/h6-7,11-12H,2-5H2,1H3;1H
InChIKeyUNTOPRWREQFUTH-UHFFFAOYSA-N
XLogP2.05
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.76
LogP ≤ 52.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(4-methylthiophen-2-yl)piperidin-4-ol;hydrochloride?
The IUPAC name of 4-(4-methylthiophen-2-yl)piperidin-4-ol;hydrochloride (CID 67869406) is 4-(4-methylthiophen-2-yl)piperidin-4-ol;hydrochloride.
What is the SMILES notation for 4-(4-methylthiophen-2-yl)piperidin-4-ol;hydrochloride?
The canonical SMILES for 4-(4-methylthiophen-2-yl)piperidin-4-ol;hydrochloride is Cc1csc(C2(O)CCNCC2)c1.Cl.
What is the InChIKey of 4-(4-methylthiophen-2-yl)piperidin-4-ol;hydrochloride?
The InChIKey is UNTOPRWREQFUTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NOS.ClH/c1-8-6-9(13-7-8)10(12)2-4-11-5-3-10;/h6-7,11-12H,2-5H2,1H3;1H.
What are the key properties of 4-(4-methylthiophen-2-yl)piperidin-4-ol;hydrochloride?
4-(4-methylthiophen-2-yl)piperidin-4-ol;hydrochloride has a molecular weight of 233.76 g/mol, XLogP of 2.05, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methylthiophen-2-yl)piperidin-4-ol;hydrochloride is sourced from PubChem (CID 67869406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).