(3-methylthiophen-2-yl)-(1-morpholin-4-ylcyclopentyl)methanol

C15H23NO2S — CID 79989145

IUPAC(3-methylthiophen-2-yl)-(1-morpholin-4-ylcyclopentyl)methanol
SMILESCc1ccsc1C(O)C1(N2CCOCC2)CCCC1
InChIInChI=1S/C15H23NO2S/c1-12-4-11-19-13(12)14(17)15(5-2-3-6-15)16-7-9-18-10-8-16/h4,11,14,17H,2-3,5-10H2,1H3
InChIKeyCSNFFEYRKIXFJJ-UHFFFAOYSA-N
MW281.42 g/mol
LogP2.73
Rot. Bonds3

About (3-methylthiophen-2-yl)-(1-morpholin-4-ylcyclopentyl)methanol

(3-methylthiophen-2-yl)-(1-morpholin-4-ylcyclopentyl)methanol (PubChem CID 79989145) has the molecular formula C15H23NO2S and a molecular weight of 281.42 g/mol. Its IUPAC name is (3-methylthiophen-2-yl)-(1-morpholin-4-ylcyclopentyl)methanol.

Molecular Properties

Compound Name(3-methylthiophen-2-yl)-(1-morpholin-4-ylcyclopentyl)methanol
PubChem CID79989145
Molecular FormulaC15H23NO2S
Molecular Weight281.42 g/mol
Exact Mass281.14
IUPAC Name(3-methylthiophen-2-yl)-(1-morpholin-4-ylcyclopentyl)methanol
SMILESCc1ccsc1C(O)C1(N2CCOCC2)CCCC1
InChIInChI=1S/C15H23NO2S/c1-12-4-11-19-13(12)14(17)15(5-2-3-6-15)16-7-9-18-10-8-16/h4,11,14,17H,2-3,5-10H2,1H3
InChIKeyCSNFFEYRKIXFJJ-UHFFFAOYSA-N
XLogP2.73
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.42
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (3-methylthiophen-2-yl)-(1-morpholin-4-ylcyclopentyl)methanol?
The IUPAC name of (3-methylthiophen-2-yl)-(1-morpholin-4-ylcyclopentyl)methanol (CID 79989145) is (3-methylthiophen-2-yl)-(1-morpholin-4-ylcyclopentyl)methanol.
What is the SMILES notation for (3-methylthiophen-2-yl)-(1-morpholin-4-ylcyclopentyl)methanol?
The canonical SMILES for (3-methylthiophen-2-yl)-(1-morpholin-4-ylcyclopentyl)methanol is Cc1ccsc1C(O)C1(N2CCOCC2)CCCC1.
What is the InChIKey of (3-methylthiophen-2-yl)-(1-morpholin-4-ylcyclopentyl)methanol?
The InChIKey is CSNFFEYRKIXFJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2S/c1-12-4-11-19-13(12)14(17)15(5-2-3-6-15)16-7-9-18-10-8-16/h4,11,14,17H,2-3,5-10H2,1H3.
What are the key properties of (3-methylthiophen-2-yl)-(1-morpholin-4-ylcyclopentyl)methanol?
(3-methylthiophen-2-yl)-(1-morpholin-4-ylcyclopentyl)methanol has a molecular weight of 281.42 g/mol, XLogP of 2.73, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methylthiophen-2-yl)-(1-morpholin-4-ylcyclopentyl)methanol is sourced from PubChem (CID 79989145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).