2-cyclohexylidenethiolane

C10H16S — CID 11789613

IUPAC2-cyclohexylidenethiolane
SMILESC1CCC(=C2CCCS2)CC1
InChIInChI=1S/C10H16S/c1-2-5-9(6-3-1)10-7-4-8-11-10/h1-8H2
InChIKeyLSBTXFWAPVJDHN-UHFFFAOYSA-N
MW168.30 g/mol
LogP3.73
Rot. Bonds

About 2-cyclohexylidenethiolane

2-cyclohexylidenethiolane (PubChem CID 11789613) has the molecular formula C10H16S and a molecular weight of 168.30 g/mol. Its IUPAC name is 2-cyclohexylidenethiolane.

Molecular Properties

Compound Name2-cyclohexylidenethiolane
PubChem CID11789613
Molecular FormulaC10H16S
Molecular Weight168.30 g/mol
Exact Mass168.10
IUPAC Name2-cyclohexylidenethiolane
SMILESC1CCC(=C2CCCS2)CC1
InChIInChI=1S/C10H16S/c1-2-5-9(6-3-1)10-7-4-8-11-10/h1-8H2
InChIKeyLSBTXFWAPVJDHN-UHFFFAOYSA-N
XLogP3.73
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.30
LogP ≤ 53.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-Methylsulfanylpropylidenecyclohexane
CID 12397148
4,5-Dibutyl-2,3-dihydrothiophene
CID 121007950
(E)-5-methyl-6-propylsulfanyldec-5-ene
CID 132579850
1-Butylsulfanylethylidenecyclohexane
CID 134932390
1-Cyclohexylsulfanyl-2-methylcyclohexene
CID 134933290
2-Cyclohexylidene-5-methylthiolane
CID 134996210
(2Z)-2-heptan-3-ylidenethiolane
CID 134996419
(2E)-2-heptan-3-ylidenethiolane
CID 135075642
4-Cyclohexylidenethiane
CID 10442355
3-Cyclohexylidenethiolane
CID 88988809
5-ethyl-6-methyl-3,4-dihydro-2H-thiopyran
CID 89338393
7-Ethylsulfanyl-2,3-dimethylhept-2-ene
CID 91079970

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexylidenethiolane?
The IUPAC name of 2-cyclohexylidenethiolane (CID 11789613) is 2-cyclohexylidenethiolane.
What is the SMILES notation for 2-cyclohexylidenethiolane?
The canonical SMILES for 2-cyclohexylidenethiolane is C1CCC(=C2CCCS2)CC1.
What is the InChIKey of 2-cyclohexylidenethiolane?
The InChIKey is LSBTXFWAPVJDHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16S/c1-2-5-9(6-3-1)10-7-4-8-11-10/h1-8H2.
What are the key properties of 2-cyclohexylidenethiolane?
2-cyclohexylidenethiolane has a molecular weight of 168.30 g/mol, XLogP of 3.73, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexylidenethiolane is sourced from PubChem (CID 11789613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).