2-[methyl(thiolan-3-yl)amino]cyclohexan-1-ol

C11H21NOS — CID 60883837

IUPAC2-[methyl(thiolan-3-yl)amino]cyclohexan-1-ol
SMILESCN(C1CCSC1)C1CCCCC1O
InChIInChI=1S/C11H21NOS/c1-12(9-6-7-14-8-9)10-4-2-3-5-11(10)13/h9-11,13H,2-8H2,1H3
InChIKeyGDKAYHLSYDIVBA-UHFFFAOYSA-N
MW215.36 g/mol
LogP1.73
Rot. Bonds2

About 2-[methyl(thiolan-3-yl)amino]cyclohexan-1-ol

2-[methyl(thiolan-3-yl)amino]cyclohexan-1-ol (PubChem CID 60883837) has the molecular formula C11H21NOS and a molecular weight of 215.36 g/mol. Its IUPAC name is 2-[methyl(thiolan-3-yl)amino]cyclohexan-1-ol.

Molecular Properties

Compound Name2-[methyl(thiolan-3-yl)amino]cyclohexan-1-ol
PubChem CID60883837
Molecular FormulaC11H21NOS
Molecular Weight215.36 g/mol
Exact Mass215.13
IUPAC Name2-[methyl(thiolan-3-yl)amino]cyclohexan-1-ol
SMILESCN(C1CCSC1)C1CCCCC1O
InChIInChI=1S/C11H21NOS/c1-12(9-6-7-14-8-9)10-4-2-3-5-11(10)13/h9-11,13H,2-8H2,1H3
InChIKeyGDKAYHLSYDIVBA-UHFFFAOYSA-N
XLogP1.73
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.36
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[methyl(thiolan-3-yl)amino]cyclohexan-1-ol 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

trans-(1R,2R)-2-[cyclopropyl(methyl)amino]cyclohexan-1-ol
CID 102731882
trans-(1S,2S)-2-[cyclohexyl(methyl)amino]cyclohexan-1-ol
CID 93317461
2-[(2-hydroxycyclohexyl)-methylamino]cycloheptan-1-ol
CID 102635791
2-[azetidin-3-yl(methyl)amino]cyclohexan-1-ol
CID 66185277
2-[methyl-(4-methylcyclohexyl)amino]cyclohexan-1-ol
CID 60714732
2-[methyl-(4-methylcyclohexyl)amino]cyclopentan-1-ol
CID 60711910
2-[azetidin-3-yl(methyl)amino]cyclopentan-1-ol
CID 66184796
trans-(1S,2S)-2-[(4,4-dimethylcyclohexyl)-methylamino]cyclopentan-1-ol
CID 102734871
2-[(3-aminocyclohexyl)-methylamino]cyclohexan-1-ol
CID 102640048
trans-(1R,2R)-2-[methyl-(2-methylcyclohexyl)amino]cyclohexan-1-ol
CID 102732058
2-[methyl-(3-methylcyclohexyl)amino]cyclopentan-1-ol
CID 61446890
2-[methyl-(3-methylsulfonylcyclohexyl)amino]cyclohexan-1-ol
CID 102636517

Frequently Asked Questions

What is the IUPAC name of 2-[methyl(thiolan-3-yl)amino]cyclohexan-1-ol?
The IUPAC name of 2-[methyl(thiolan-3-yl)amino]cyclohexan-1-ol (CID 60883837) is 2-[methyl(thiolan-3-yl)amino]cyclohexan-1-ol.
What is the SMILES notation for 2-[methyl(thiolan-3-yl)amino]cyclohexan-1-ol?
The canonical SMILES for 2-[methyl(thiolan-3-yl)amino]cyclohexan-1-ol is CN(C1CCSC1)C1CCCCC1O.
What is the InChIKey of 2-[methyl(thiolan-3-yl)amino]cyclohexan-1-ol?
The InChIKey is GDKAYHLSYDIVBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NOS/c1-12(9-6-7-14-8-9)10-4-2-3-5-11(10)13/h9-11,13H,2-8H2,1H3.
What are the key properties of 2-[methyl(thiolan-3-yl)amino]cyclohexan-1-ol?
2-[methyl(thiolan-3-yl)amino]cyclohexan-1-ol has a molecular weight of 215.36 g/mol, XLogP of 1.73, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl(thiolan-3-yl)amino]cyclohexan-1-ol is sourced from PubChem (CID 60883837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).