5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-(3-methylcyclohexyl)methanol

C15H22OS — CID 115808210

IUPAC5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-(3-methylcyclohexyl)methanol
SMILESCC1CCCC(C(O)c2cc3c(s2)CCC3)C1
InChIInChI=1S/C15H22OS/c1-10-4-2-6-12(8-10)15(16)14-9-11-5-3-7-13(11)17-14/h9-10,12,15-16H,2-8H2,1H3
InChIKeyMNMFXXIKQXKUEA-UHFFFAOYSA-N
MW250.41 g/mol
LogP4.10
Rot. Bonds2

About 5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-(3-methylcyclohexyl)methanol

5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-(3-methylcyclohexyl)methanol (PubChem CID 115808210) has the molecular formula C15H22OS and a molecular weight of 250.41 g/mol. Its IUPAC name is 5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-(3-methylcyclohexyl)methanol.

Molecular Properties

Compound Name5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-(3-methylcyclohexyl)methanol
PubChem CID115808210
Molecular FormulaC15H22OS
Molecular Weight250.41 g/mol
Exact Mass250.14
IUPAC Name5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-(3-methylcyclohexyl)methanol
SMILESCC1CCCC(C(O)c2cc3c(s2)CCC3)C1
InChIInChI=1S/C15H22OS/c1-10-4-2-6-12(8-10)15(16)14-9-11-5-3-7-13(11)17-14/h9-10,12,15-16H,2-8H2,1H3
InChIKeyMNMFXXIKQXKUEA-UHFFFAOYSA-N
XLogP4.10
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.41
LogP ≤ 54.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-(3-methylcyclohexyl)methanol?
The IUPAC name of 5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-(3-methylcyclohexyl)methanol (CID 115808210) is 5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-(3-methylcyclohexyl)methanol.
What is the SMILES notation for 5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-(3-methylcyclohexyl)methanol?
The canonical SMILES for 5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-(3-methylcyclohexyl)methanol is CC1CCCC(C(O)c2cc3c(s2)CCC3)C1.
What is the InChIKey of 5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-(3-methylcyclohexyl)methanol?
The InChIKey is MNMFXXIKQXKUEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22OS/c1-10-4-2-6-12(8-10)15(16)14-9-11-5-3-7-13(11)17-14/h9-10,12,15-16H,2-8H2,1H3.
What are the key properties of 5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-(3-methylcyclohexyl)methanol?
5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-(3-methylcyclohexyl)methanol has a molecular weight of 250.41 g/mol, XLogP of 4.10, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dihydro-4H-cyclopenta[b]thiophen-2-yl-(3-methylcyclohexyl)methanol is sourced from PubChem (CID 115808210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).