1-cyclopropyl-N-[(1S,2S)-2-hydroxycyclohexyl]methanesulfonamide

C10H19NO3S — CID 104953228

IUPAC1-cyclopropyl-N-[(1S,2S)-2-hydroxycyclohexyl]methanesulfonamide
SMILESO=S(=O)(CC1CC1)N[C@H]1CCCC[C@@H]1O
InChIInChI=1S/C10H19NO3S/c12-10-4-2-1-3-9(10)11-15(13,14)7-8-5-6-8/h8-12H,1-7H2/t9-,10-/m0/s1
InChIKeyHXOGGLVCQSKJLP-UWVGGRQHSA-N
MW233.33 g/mol
LogP0.62
Rot. Bonds4

About 1-cyclopropyl-N-[(1S,2S)-2-hydroxycyclohexyl]methanesulfonamide

1-cyclopropyl-N-[(1S,2S)-2-hydroxycyclohexyl]methanesulfonamide (PubChem CID 104953228) has the molecular formula C10H19NO3S and a molecular weight of 233.33 g/mol. Its IUPAC name is 1-cyclopropyl-N-[(1S,2S)-2-hydroxycyclohexyl]methanesulfonamide.

Molecular Properties

Compound Name1-cyclopropyl-N-[(1S,2S)-2-hydroxycyclohexyl]methanesulfonamide
PubChem CID104953228
Molecular FormulaC10H19NO3S
Molecular Weight233.33 g/mol
Exact Mass233.11
IUPAC Name1-cyclopropyl-N-[(1S,2S)-2-hydroxycyclohexyl]methanesulfonamide
SMILESO=S(=O)(CC1CC1)N[C@H]1CCCC[C@@H]1O
InChIInChI=1S/C10H19NO3S/c12-10-4-2-1-3-9(10)11-15(13,14)7-8-5-6-8/h8-12H,1-7H2/t9-,10-/m0/s1
InChIKeyHXOGGLVCQSKJLP-UWVGGRQHSA-N
XLogP0.62
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.33
LogP ≤ 50.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-chloro-N-[(1R,2R)-2-hydroxycyclohexyl]methanesulfonamide
CID 107858977
2-chloro-N-[(1S,2S)-2-hydroxycyclohexyl]ethanesulfonamide
CID 107858968
3-chloro-N-[(1R,2R)-2-hydroxycyclohexyl]propane-1-sulfonamide
CID 107858978
N-(2-bromocyclohexyl)-1-cyclohexylmethanesulfonamide
CID 114297347
N-(2-aminocyclohexyl)-1-cycloheptylmethanesulfonamide
CID 59537369
1-cyclohexyl-N-[2-(hydroxymethyl)cyclopentyl]methanesulfonamide
CID 103697794
4-[[(1R,2R)-2-hydroxycyclohexyl]sulfamoyl]butanoic acid
CID 107216293
ethyl 2-[[(1R,2R)-2-hydroxycyclohexyl]sulfamoyl]acetate
CID 104922331
N-[2-(aminomethyl)cyclopentyl]-1-cyclohexylmethanesulfonamide
CID 62955693
2-(cyclopropylmethylsulfonylamino)cyclopentane-1-carboximidamide
CID 64989052
2-(methylsulfamoylamino)cycloheptan-1-ol
CID 114809764
cis-(1R,2S)-2-(cyclopropylmethylamino)cyclohexan-1-ol
CID 58627713

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-[(1S,2S)-2-hydroxycyclohexyl]methanesulfonamide?
The IUPAC name of 1-cyclopropyl-N-[(1S,2S)-2-hydroxycyclohexyl]methanesulfonamide (CID 104953228) is 1-cyclopropyl-N-[(1S,2S)-2-hydroxycyclohexyl]methanesulfonamide.
What is the SMILES notation for 1-cyclopropyl-N-[(1S,2S)-2-hydroxycyclohexyl]methanesulfonamide?
The canonical SMILES for 1-cyclopropyl-N-[(1S,2S)-2-hydroxycyclohexyl]methanesulfonamide is O=S(=O)(CC1CC1)N[C@H]1CCCC[C@@H]1O.
What is the InChIKey of 1-cyclopropyl-N-[(1S,2S)-2-hydroxycyclohexyl]methanesulfonamide?
The InChIKey is HXOGGLVCQSKJLP-UWVGGRQHSA-N. The full InChI is InChI=1S/C10H19NO3S/c12-10-4-2-1-3-9(10)11-15(13,14)7-8-5-6-8/h8-12H,1-7H2/t9-,10-/m0/s1.
What are the key properties of 1-cyclopropyl-N-[(1S,2S)-2-hydroxycyclohexyl]methanesulfonamide?
1-cyclopropyl-N-[(1S,2S)-2-hydroxycyclohexyl]methanesulfonamide has a molecular weight of 233.33 g/mol, XLogP of 0.62, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-[(1S,2S)-2-hydroxycyclohexyl]methanesulfonamide is sourced from PubChem (CID 104953228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).