3-(methoxymethyl)-1-piperidin-1-ylsulfonylazetidin-3-ol

C10H20N2O4S — CID 138044791

IUPAC3-(methoxymethyl)-1-piperidin-1-ylsulfonylazetidin-3-ol
SMILESCOCC1(O)CN(S(=O)(=O)N2CCCCC2)C1
InChIInChI=1S/C10H20N2O4S/c1-16-9-10(13)7-12(8-10)17(14,15)11-5-3-2-4-6-11/h13H,2-9H2,1H3
InChIKeyJFKCEUBZBQZACN-UHFFFAOYSA-N
MW264.35 g/mol
LogP-0.59
Rot. Bonds4

About 3-(methoxymethyl)-1-piperidin-1-ylsulfonylazetidin-3-ol

3-(methoxymethyl)-1-piperidin-1-ylsulfonylazetidin-3-ol (PubChem CID 138044791) has the molecular formula C10H20N2O4S and a molecular weight of 264.35 g/mol. Its IUPAC name is 3-(methoxymethyl)-1-piperidin-1-ylsulfonylazetidin-3-ol.

Molecular Properties

Compound Name3-(methoxymethyl)-1-piperidin-1-ylsulfonylazetidin-3-ol
PubChem CID138044791
Molecular FormulaC10H20N2O4S
Molecular Weight264.35 g/mol
Exact Mass264.11
IUPAC Name3-(methoxymethyl)-1-piperidin-1-ylsulfonylazetidin-3-ol
SMILESCOCC1(O)CN(S(=O)(=O)N2CCCCC2)C1
InChIInChI=1S/C10H20N2O4S/c1-16-9-10(13)7-12(8-10)17(14,15)11-5-3-2-4-6-11/h13H,2-9H2,1H3
InChIKeyJFKCEUBZBQZACN-UHFFFAOYSA-N
XLogP-0.59
TPSA70.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.35
LogP ≤ 5-0.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-ethenylsulfonyl-3-(methoxymethyl)piperidin-3-ol
CID 167943862
1-(4-piperidin-1-ylsulfonylpiperazin-1-yl)sulfonylazepane
CID 2238490
1-(methoxymethyl)cyclohexan-1-ol
CID 12552140
[(3R)-1-(azepan-1-ylsulfonyl)-3-(3-methoxypropyl)piperidin-3-yl]methanol
CID 97142125
4-methyl-1-pyrrolidin-1-ylsulfonylazepan-4-ol
CID 107407041
1,4-bis(pyrrolidin-1-ylsulfonyl)-1,4-diazepane
CID 39730535
1-(azetidin-1-ylsulfonyl)azetidine
CID 69400792
N-[[4-(methoxymethyl)piperidin-4-yl]methyl]azepane-1-sulfonamide
CID 120896907
methyl 1-piperidin-1-ylsulfonylazepane-3-carboxylate
CID 57416008
[1-(azepan-1-ylsulfonyl)-3-methylpyrrolidin-3-yl]methanamine;hydrochloride
CID 120777813
methyl (3S)-1-piperidin-1-ylsulfonylpiperidine-3-carboxylate
CID 79033124
N-(2-methoxyethyl)-1-pyrrolidin-1-ylsulfonylpiperidine-4-carboxamide
CID 5058959

Frequently Asked Questions

What is the IUPAC name of 3-(methoxymethyl)-1-piperidin-1-ylsulfonylazetidin-3-ol?
The IUPAC name of 3-(methoxymethyl)-1-piperidin-1-ylsulfonylazetidin-3-ol (CID 138044791) is 3-(methoxymethyl)-1-piperidin-1-ylsulfonylazetidin-3-ol.
What is the SMILES notation for 3-(methoxymethyl)-1-piperidin-1-ylsulfonylazetidin-3-ol?
The canonical SMILES for 3-(methoxymethyl)-1-piperidin-1-ylsulfonylazetidin-3-ol is COCC1(O)CN(S(=O)(=O)N2CCCCC2)C1.
What is the InChIKey of 3-(methoxymethyl)-1-piperidin-1-ylsulfonylazetidin-3-ol?
The InChIKey is JFKCEUBZBQZACN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O4S/c1-16-9-10(13)7-12(8-10)17(14,15)11-5-3-2-4-6-11/h13H,2-9H2,1H3.
What are the key properties of 3-(methoxymethyl)-1-piperidin-1-ylsulfonylazetidin-3-ol?
3-(methoxymethyl)-1-piperidin-1-ylsulfonylazetidin-3-ol has a molecular weight of 264.35 g/mol, XLogP of -0.59, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methoxymethyl)-1-piperidin-1-ylsulfonylazetidin-3-ol is sourced from PubChem (CID 138044791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).