(5-methylthiophen-3-yl)-(1-piperidin-1-ylcyclopentyl)methanol

C16H25NOS — CID 79059249

IUPAC(5-methylthiophen-3-yl)-(1-piperidin-1-ylcyclopentyl)methanol
SMILESCc1cc(C(O)C2(N3CCCCC3)CCCC2)cs1
InChIInChI=1S/C16H25NOS/c1-13-11-14(12-19-13)15(18)16(7-3-4-8-16)17-9-5-2-6-10-17/h11-12,15,18H,2-10H2,1H3
InChIKeyJFFVFMMECMZGPR-UHFFFAOYSA-N
MW279.45 g/mol
LogP3.89
Rot. Bonds3

About (5-methylthiophen-3-yl)-(1-piperidin-1-ylcyclopentyl)methanol

(5-methylthiophen-3-yl)-(1-piperidin-1-ylcyclopentyl)methanol (PubChem CID 79059249) has the molecular formula C16H25NOS and a molecular weight of 279.45 g/mol. Its IUPAC name is (5-methylthiophen-3-yl)-(1-piperidin-1-ylcyclopentyl)methanol.

Molecular Properties

Compound Name(5-methylthiophen-3-yl)-(1-piperidin-1-ylcyclopentyl)methanol
PubChem CID79059249
Molecular FormulaC16H25NOS
Molecular Weight279.45 g/mol
Exact Mass279.17
IUPAC Name(5-methylthiophen-3-yl)-(1-piperidin-1-ylcyclopentyl)methanol
SMILESCc1cc(C(O)C2(N3CCCCC3)CCCC2)cs1
InChIInChI=1S/C16H25NOS/c1-13-11-14(12-19-13)15(18)16(7-3-4-8-16)17-9-5-2-6-10-17/h11-12,15,18H,2-10H2,1H3
InChIKeyJFFVFMMECMZGPR-UHFFFAOYSA-N
XLogP3.89
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.45
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (5-methylthiophen-3-yl)-(1-piperidin-1-ylcyclopentyl)methanol?
The IUPAC name of (5-methylthiophen-3-yl)-(1-piperidin-1-ylcyclopentyl)methanol (CID 79059249) is (5-methylthiophen-3-yl)-(1-piperidin-1-ylcyclopentyl)methanol.
What is the SMILES notation for (5-methylthiophen-3-yl)-(1-piperidin-1-ylcyclopentyl)methanol?
The canonical SMILES for (5-methylthiophen-3-yl)-(1-piperidin-1-ylcyclopentyl)methanol is Cc1cc(C(O)C2(N3CCCCC3)CCCC2)cs1.
What is the InChIKey of (5-methylthiophen-3-yl)-(1-piperidin-1-ylcyclopentyl)methanol?
The InChIKey is JFFVFMMECMZGPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NOS/c1-13-11-14(12-19-13)15(18)16(7-3-4-8-16)17-9-5-2-6-10-17/h11-12,15,18H,2-10H2,1H3.
What are the key properties of (5-methylthiophen-3-yl)-(1-piperidin-1-ylcyclopentyl)methanol?
(5-methylthiophen-3-yl)-(1-piperidin-1-ylcyclopentyl)methanol has a molecular weight of 279.45 g/mol, XLogP of 3.89, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methylthiophen-3-yl)-(1-piperidin-1-ylcyclopentyl)methanol is sourced from PubChem (CID 79059249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).