(2R)-2-methoxy-N-[(1S,2R)-2-pyrazol-1-ylcyclohexyl]propane-1-sulfonamide

C13H23N3O3S — CID 124830196

IUPAC(2R)-2-methoxy-N-[(1S,2R)-2-pyrazol-1-ylcyclohexyl]propane-1-sulfonamide
SMILESCO[C@H](C)CS(=O)(=O)N[C@H]1CCCC[C@H]1n1cccn1
InChIInChI=1S/C13H23N3O3S/c1-11(19-2)10-20(17,18)15-12-6-3-4-7-13(12)16-9-5-8-14-16/h5,8-9,11-13,15H,3-4,6-7,10H2,1-2H3/t11-,12+,13-/m1/s1
InChIKeyFDENBCUTDPSFNW-FRRDWIJNSA-N
MW301.41 g/mol
LogP1.32
Rot. Bonds6

About (2R)-2-methoxy-N-[(1S,2R)-2-pyrazol-1-ylcyclohexyl]propane-1-sulfonamide

(2R)-2-methoxy-N-[(1S,2R)-2-pyrazol-1-ylcyclohexyl]propane-1-sulfonamide (PubChem CID 124830196) has the molecular formula C13H23N3O3S and a molecular weight of 301.41 g/mol. Its IUPAC name is (2R)-2-methoxy-N-[(1S,2R)-2-pyrazol-1-ylcyclohexyl]propane-1-sulfonamide.

Molecular Properties

Compound Name(2R)-2-methoxy-N-[(1S,2R)-2-pyrazol-1-ylcyclohexyl]propane-1-sulfonamide
PubChem CID124830196
Molecular FormulaC13H23N3O3S
Molecular Weight301.41 g/mol
Exact Mass301.15
IUPAC Name(2R)-2-methoxy-N-[(1S,2R)-2-pyrazol-1-ylcyclohexyl]propane-1-sulfonamide
SMILESCO[C@H](C)CS(=O)(=O)N[C@H]1CCCC[C@H]1n1cccn1
InChIInChI=1S/C13H23N3O3S/c1-11(19-2)10-20(17,18)15-12-6-3-4-7-13(12)16-9-5-8-14-16/h5,8-9,11-13,15H,3-4,6-7,10H2,1-2H3/t11-,12+,13-/m1/s1
InChIKeyFDENBCUTDPSFNW-FRRDWIJNSA-N
XLogP1.32
TPSA73.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.41
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-methoxy-N-(2-methyloxolan-3-yl)propane-1-sulfonamide
CID 136540395
1-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-3-[(1R,2S)-2-pyrazol-1-ylcyclohexyl]urea
CID 96566707
1-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-3-[(1S,2S)-2-pyrazol-1-ylcyclohexyl]urea
CID 96566708
(2S)-N-(2-fluoroethyl)-2-[[(1S,2R)-2-pyrazol-1-ylcyclohexyl]carbamoylamino]propanamide
CID 124850298
(2R)-2-methoxy-N-[1-[(3-methylphenyl)methyl]piperidin-4-yl]propane-1-sulfonamide
CID 124735855
cis-(1R,2S)-N-(3-imidazol-1-ylpropyl)-2-pyrazol-1-ylcyclohexan-1-amine
CID 99622517
6-chloro-N-[(1R,2S)-2-pyrazol-1-ylcyclohexyl]pyrazin-2-amine
CID 95968560
2-methoxy-N-piperidin-4-ylpropane-1-sulfonamide;hydrochloride
CID 120998878
1-[(2R)-2-(5-methyl-1,3-thiazol-2-yl)propyl]-3-[(1S,2R)-2-pyrazol-1-ylcyclohexyl]urea
CID 129421233
1-(3-methyl-1,2-oxazol-5-yl)-3-[(1R,2S)-2-pyrazol-1-ylcyclopentyl]urea
CID 154845601
2-methoxy-N-pyrazolo[1,5-a]pyrimidin-6-ylpropane-1-sulfonamide
CID 126833445
(1R,5S)-9-hydroxy-N-[(1R,2R)-2-pyrazol-1-ylcyclohexyl]-3-azabicyclo[3.3.1]nonane-3-carboxamide
CID 124730444

Frequently Asked Questions

What is the IUPAC name of (2R)-2-methoxy-N-[(1S,2R)-2-pyrazol-1-ylcyclohexyl]propane-1-sulfonamide?
The IUPAC name of (2R)-2-methoxy-N-[(1S,2R)-2-pyrazol-1-ylcyclohexyl]propane-1-sulfonamide (CID 124830196) is (2R)-2-methoxy-N-[(1S,2R)-2-pyrazol-1-ylcyclohexyl]propane-1-sulfonamide.
What is the SMILES notation for (2R)-2-methoxy-N-[(1S,2R)-2-pyrazol-1-ylcyclohexyl]propane-1-sulfonamide?
The canonical SMILES for (2R)-2-methoxy-N-[(1S,2R)-2-pyrazol-1-ylcyclohexyl]propane-1-sulfonamide is CO[C@H](C)CS(=O)(=O)N[C@H]1CCCC[C@H]1n1cccn1.
What is the InChIKey of (2R)-2-methoxy-N-[(1S,2R)-2-pyrazol-1-ylcyclohexyl]propane-1-sulfonamide?
The InChIKey is FDENBCUTDPSFNW-FRRDWIJNSA-N. The full InChI is InChI=1S/C13H23N3O3S/c1-11(19-2)10-20(17,18)15-12-6-3-4-7-13(12)16-9-5-8-14-16/h5,8-9,11-13,15H,3-4,6-7,10H2,1-2H3/t11-,12+,13-/m1/s1.
What are the key properties of (2R)-2-methoxy-N-[(1S,2R)-2-pyrazol-1-ylcyclohexyl]propane-1-sulfonamide?
(2R)-2-methoxy-N-[(1S,2R)-2-pyrazol-1-ylcyclohexyl]propane-1-sulfonamide has a molecular weight of 301.41 g/mol, XLogP of 1.32, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-methoxy-N-[(1S,2R)-2-pyrazol-1-ylcyclohexyl]propane-1-sulfonamide is sourced from PubChem (CID 124830196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).