1-(2-methylpyrazol-3-yl)sulfonyl-4-[[(2S)-oxan-2-yl]methoxy]piperidine

C15H25N3O4S — CID 124727248

IUPAC1-(2-methylpyrazol-3-yl)sulfonyl-4-[[(2S)-oxan-2-yl]methoxy]piperidine
SMILESCn1nccc1S(=O)(=O)N1CCC(OC[C@@H]2CCCCO2)CC1
InChIInChI=1S/C15H25N3O4S/c1-17-15(5-8-16-17)23(19,20)18-9-6-13(7-10-18)22-12-14-4-2-3-11-21-14/h5,8,13-14H,2-4,6-7,9-12H2,1H3/t14-/m0/s1
InChIKeyCSRBDDVQVRESKF-AWEZNQCLSA-N
MW343.45 g/mol
LogP1.16
Rot. Bonds5

About 1-(2-methylpyrazol-3-yl)sulfonyl-4-[[(2S)-oxan-2-yl]methoxy]piperidine

1-(2-methylpyrazol-3-yl)sulfonyl-4-[[(2S)-oxan-2-yl]methoxy]piperidine (PubChem CID 124727248) has the molecular formula C15H25N3O4S and a molecular weight of 343.45 g/mol. Its IUPAC name is 1-(2-methylpyrazol-3-yl)sulfonyl-4-[[(2S)-oxan-2-yl]methoxy]piperidine.

Molecular Properties

Compound Name1-(2-methylpyrazol-3-yl)sulfonyl-4-[[(2S)-oxan-2-yl]methoxy]piperidine
PubChem CID124727248
Molecular FormulaC15H25N3O4S
Molecular Weight343.45 g/mol
Exact Mass343.16
IUPAC Name1-(2-methylpyrazol-3-yl)sulfonyl-4-[[(2S)-oxan-2-yl]methoxy]piperidine
SMILESCn1nccc1S(=O)(=O)N1CCC(OC[C@@H]2CCCCO2)CC1
InChIInChI=1S/C15H25N3O4S/c1-17-15(5-8-16-17)23(19,20)18-9-6-13(7-10-18)22-12-14-4-2-3-11-21-14/h5,8,13-14H,2-4,6-7,9-12H2,1H3/t14-/m0/s1
InChIKeyCSRBDDVQVRESKF-AWEZNQCLSA-N
XLogP1.16
TPSA73.66 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.45
LogP ≤ 51.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

1-[(4-chloro-1-methylpyrazol-5-yl)methyl]-4-[[(2R)-oxan-2-yl]methoxy]piperidine
CID 124619404
1-(2-methylpyrazol-3-yl)sulfonylpiperidin-4-one
CID 104709956
methyl 1-(2-methylpyrazol-3-yl)sulfonylpiperidine-4-carboxylate
CID 113444014
3-methyl-1-(2-methylpyrazol-3-yl)sulfonylpiperidin-4-amine
CID 104710309
5-[3-(2-chloroethyl)pyrrolidin-1-yl]sulfonyl-1-methylpyrazole
CID 114801854
(2,6-dimethyl-3-pyridinyl)-[4-(oxan-2-ylmethoxy)piperidin-1-yl]methanone
CID 154794617
7-chloro-8-[[4-(oxan-2-ylmethoxy)piperidin-1-yl]methyl]quinoline
CID 102559179
2-(4-methylphenyl)-5-[[4-(oxan-2-ylmethoxy)piperidin-1-yl]methyl]-1,3,4-oxadiazole
CID 127418614
1-(2-methylpyrazol-3-yl)sulfonylpyrrolidine-3-carboxylic acid
CID 104709610
(1S)-2-[4-[[(2S)-oxan-2-yl]methoxy]piperidin-1-yl]-1-phenylethanol
CID 124883143
3-methyl-6-[4-[[(2R)-oxan-2-yl]methoxy]piperidin-1-yl]-[1,2,4]triazolo[4,3-b]pyridazine
CID 97009492
4-[[(2R)-oxolan-2-yl]methoxy]-1-[(2-pyrazol-1-ylphenyl)methyl]piperidine
CID 97157965

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylpyrazol-3-yl)sulfonyl-4-[[(2S)-oxan-2-yl]methoxy]piperidine?
The IUPAC name of 1-(2-methylpyrazol-3-yl)sulfonyl-4-[[(2S)-oxan-2-yl]methoxy]piperidine (CID 124727248) is 1-(2-methylpyrazol-3-yl)sulfonyl-4-[[(2S)-oxan-2-yl]methoxy]piperidine.
What is the SMILES notation for 1-(2-methylpyrazol-3-yl)sulfonyl-4-[[(2S)-oxan-2-yl]methoxy]piperidine?
The canonical SMILES for 1-(2-methylpyrazol-3-yl)sulfonyl-4-[[(2S)-oxan-2-yl]methoxy]piperidine is Cn1nccc1S(=O)(=O)N1CCC(OC[C@@H]2CCCCO2)CC1.
What is the InChIKey of 1-(2-methylpyrazol-3-yl)sulfonyl-4-[[(2S)-oxan-2-yl]methoxy]piperidine?
The InChIKey is CSRBDDVQVRESKF-AWEZNQCLSA-N. The full InChI is InChI=1S/C15H25N3O4S/c1-17-15(5-8-16-17)23(19,20)18-9-6-13(7-10-18)22-12-14-4-2-3-11-21-14/h5,8,13-14H,2-4,6-7,9-12H2,1H3/t14-/m0/s1.
What are the key properties of 1-(2-methylpyrazol-3-yl)sulfonyl-4-[[(2S)-oxan-2-yl]methoxy]piperidine?
1-(2-methylpyrazol-3-yl)sulfonyl-4-[[(2S)-oxan-2-yl]methoxy]piperidine has a molecular weight of 343.45 g/mol, XLogP of 1.16, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylpyrazol-3-yl)sulfonyl-4-[[(2S)-oxan-2-yl]methoxy]piperidine is sourced from PubChem (CID 124727248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).