4-(4-methylcyclohexyl)thiomorpholine

C11H21NS — CID 20761843

IUPAC4-(4-methylcyclohexyl)thiomorpholine
SMILESCC1CCC(N2CCSCC2)CC1
InChIInChI=1S/C11H21NS/c1-10-2-4-11(5-3-10)12-6-8-13-9-7-12/h10-11H,2-9H2,1H3
InChIKeyBYJIVLLKMYPPKC-UHFFFAOYSA-N
MW199.36 g/mol
LogP2.61
Rot. Bonds1

About 4-(4-methylcyclohexyl)thiomorpholine

4-(4-methylcyclohexyl)thiomorpholine (PubChem CID 20761843) has the molecular formula C11H21NS and a molecular weight of 199.36 g/mol. Its IUPAC name is 4-(4-methylcyclohexyl)thiomorpholine.

Molecular Properties

Compound Name4-(4-methylcyclohexyl)thiomorpholine
PubChem CID20761843
Molecular FormulaC11H21NS
Molecular Weight199.36 g/mol
Exact Mass199.14
IUPAC Name4-(4-methylcyclohexyl)thiomorpholine
SMILESCC1CCC(N2CCSCC2)CC1
InChIInChI=1S/C11H21NS/c1-10-2-4-11(5-3-10)12-6-8-13-9-7-12/h10-11H,2-9H2,1H3
InChIKeyBYJIVLLKMYPPKC-UHFFFAOYSA-N
XLogP2.61
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.36
LogP ≤ 52.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(4-methylcyclohexyl)thiomorpholine?
The IUPAC name of 4-(4-methylcyclohexyl)thiomorpholine (CID 20761843) is 4-(4-methylcyclohexyl)thiomorpholine.
What is the SMILES notation for 4-(4-methylcyclohexyl)thiomorpholine?
The canonical SMILES for 4-(4-methylcyclohexyl)thiomorpholine is CC1CCC(N2CCSCC2)CC1.
What is the InChIKey of 4-(4-methylcyclohexyl)thiomorpholine?
The InChIKey is BYJIVLLKMYPPKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NS/c1-10-2-4-11(5-3-10)12-6-8-13-9-7-12/h10-11H,2-9H2,1H3.
What are the key properties of 4-(4-methylcyclohexyl)thiomorpholine?
4-(4-methylcyclohexyl)thiomorpholine has a molecular weight of 199.36 g/mol, XLogP of 2.61, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methylcyclohexyl)thiomorpholine is sourced from PubChem (CID 20761843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).