5-cyclohexyl-2,3-dihydrothiophene

C10H16S — CID 10899091

IUPAC5-cyclohexyl-2,3-dihydrothiophene
SMILESC1=C(C2CCCCC2)SCC1
InChIInChI=1S/C10H16S/c1-2-5-9(6-3-1)10-7-4-8-11-10/h7,9H,1-6,8H2
InChIKeyXSRLDOXJZXMURE-UHFFFAOYSA-N
MW168.31 g/mol
LogP3.59
Rot. Bonds1

About 5-cyclohexyl-2,3-dihydrothiophene

5-cyclohexyl-2,3-dihydrothiophene (PubChem CID 10899091) has the molecular formula C10H16S and a molecular weight of 168.31 g/mol. Its IUPAC name is 5-cyclohexyl-2,3-dihydrothiophene.

Molecular Properties

Compound Name5-cyclohexyl-2,3-dihydrothiophene
PubChem CID10899091
Molecular FormulaC10H16S
Molecular Weight168.31 g/mol
Exact Mass168.10
IUPAC Name5-cyclohexyl-2,3-dihydrothiophene
SMILESC1=C(C2CCCCC2)SCC1
InChIInChI=1S/C10H16S/c1-2-5-9(6-3-1)10-7-4-8-11-10/h7,9H,1-6,8H2
InChIKeyXSRLDOXJZXMURE-UHFFFAOYSA-N
XLogP3.59
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.31
LogP ≤ 53.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 5-cyclohexyl-2,3-dihydrothiophene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4,7,7-Trimethyl-6-thiabicyclo[3.2.1]oct-3-ene
CID 110922
2(4aH)-Naphthalenone, 3,4,5,6,7,8-hexahydro-, dithiaethylene acetal
CID 607700
6-Methyl-9-prop-1-en-2-yl-1,4-dithiaspiro[4.5]dec-6-ene
CID 15625911
1-Pentylsulfanylethenylcyclohexane
CID 58150596
Hexahydro-benzo[b]thiophene
CID 67855462
5-Cyclohexyl-2-methyl-2,3-dihydrothiophene
CID 68347668
1-Ethylidene-4-(3,3,3-trifluoropropylsulfanylmethyl)cyclohexane
CID 163917748
3-Methyl-2-thiabicyclo[4.4.0]dec-3-ene
CID 12570890
3-Ethyl-2-thiabicyclo[2.2.1]hept-5-ene
CID 13429915
3-Butyl-2-thiabicyclo[2.2.1]hept-5-ene
CID 13429919
3-Cyclohexyl-2-thiabicyclo[2.2.1]hept-5-ene
CID 13429924
5-Heptan-3-yl-2,3-dihydrothiophene
CID 100984300

Frequently Asked Questions

What is the IUPAC name of 5-cyclohexyl-2,3-dihydrothiophene?
The IUPAC name of 5-cyclohexyl-2,3-dihydrothiophene (CID 10899091) is 5-cyclohexyl-2,3-dihydrothiophene.
What is the SMILES notation for 5-cyclohexyl-2,3-dihydrothiophene?
The canonical SMILES for 5-cyclohexyl-2,3-dihydrothiophene is C1=C(C2CCCCC2)SCC1.
What is the InChIKey of 5-cyclohexyl-2,3-dihydrothiophene?
The InChIKey is XSRLDOXJZXMURE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16S/c1-2-5-9(6-3-1)10-7-4-8-11-10/h7,9H,1-6,8H2.
What are the key properties of 5-cyclohexyl-2,3-dihydrothiophene?
5-cyclohexyl-2,3-dihydrothiophene has a molecular weight of 168.31 g/mol, XLogP of 3.59, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclohexyl-2,3-dihydrothiophene is sourced from PubChem (CID 10899091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).