3-cyclohexyl-2-methylbutane-2-sulfinamide

C11H23NOS — CID 89464801

IUPAC3-cyclohexyl-2-methylbutane-2-sulfinamide
SMILESCC(C1CCCCC1)C(C)(C)S(N)=O
InChIInChI=1S/C11H23NOS/c1-9(11(2,3)14(12)13)10-7-5-4-6-8-10/h9-10H,4-8,12H2,1-3H3
InChIKeyUTIVGQOXFRDLSH-UHFFFAOYSA-N
MW217.38 g/mol
LogP2.60
Rot. Bonds3

About 3-cyclohexyl-2-methylbutane-2-sulfinamide

3-cyclohexyl-2-methylbutane-2-sulfinamide (PubChem CID 89464801) has the molecular formula C11H23NOS and a molecular weight of 217.38 g/mol. Its IUPAC name is 3-cyclohexyl-2-methylbutane-2-sulfinamide.

Molecular Properties

Compound Name3-cyclohexyl-2-methylbutane-2-sulfinamide
PubChem CID89464801
Molecular FormulaC11H23NOS
Molecular Weight217.38 g/mol
Exact Mass217.15
IUPAC Name3-cyclohexyl-2-methylbutane-2-sulfinamide
SMILESCC(C1CCCCC1)C(C)(C)S(N)=O
InChIInChI=1S/C11H23NOS/c1-9(11(2,3)14(12)13)10-7-5-4-6-8-10/h9-10H,4-8,12H2,1-3H3
InChIKeyUTIVGQOXFRDLSH-UHFFFAOYSA-N
XLogP2.60
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.38
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-cyclohexyl-2-methylbutane-2-sulfinamide?
The IUPAC name of 3-cyclohexyl-2-methylbutane-2-sulfinamide (CID 89464801) is 3-cyclohexyl-2-methylbutane-2-sulfinamide.
What is the SMILES notation for 3-cyclohexyl-2-methylbutane-2-sulfinamide?
The canonical SMILES for 3-cyclohexyl-2-methylbutane-2-sulfinamide is CC(C1CCCCC1)C(C)(C)S(N)=O.
What is the InChIKey of 3-cyclohexyl-2-methylbutane-2-sulfinamide?
The InChIKey is UTIVGQOXFRDLSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NOS/c1-9(11(2,3)14(12)13)10-7-5-4-6-8-10/h9-10H,4-8,12H2,1-3H3.
What are the key properties of 3-cyclohexyl-2-methylbutane-2-sulfinamide?
3-cyclohexyl-2-methylbutane-2-sulfinamide has a molecular weight of 217.38 g/mol, XLogP of 2.60, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexyl-2-methylbutane-2-sulfinamide is sourced from PubChem (CID 89464801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).