1-cyclopentylsulfonyl-3-cyclopropylazetidin-3-ol

C11H19NO3S — CID 105361299

IUPAC1-cyclopentylsulfonyl-3-cyclopropylazetidin-3-ol
SMILESO=S(=O)(C1CCCC1)N1CC(O)(C2CC2)C1
InChIInChI=1S/C11H19NO3S/c13-11(9-5-6-9)7-12(8-11)16(14,15)10-3-1-2-4-10/h9-10,13H,1-8H2
InChIKeyKVLQSNIHLKUSSQ-UHFFFAOYSA-N
MW245.34 g/mol
LogP0.72
Rot. Bonds3

About 1-cyclopentylsulfonyl-3-cyclopropylazetidin-3-ol

1-cyclopentylsulfonyl-3-cyclopropylazetidin-3-ol (PubChem CID 105361299) has the molecular formula C11H19NO3S and a molecular weight of 245.34 g/mol. Its IUPAC name is 1-cyclopentylsulfonyl-3-cyclopropylazetidin-3-ol.

Molecular Properties

Compound Name1-cyclopentylsulfonyl-3-cyclopropylazetidin-3-ol
PubChem CID105361299
Molecular FormulaC11H19NO3S
Molecular Weight245.34 g/mol
Exact Mass245.11
IUPAC Name1-cyclopentylsulfonyl-3-cyclopropylazetidin-3-ol
SMILESO=S(=O)(C1CCCC1)N1CC(O)(C2CC2)C1
InChIInChI=1S/C11H19NO3S/c13-11(9-5-6-9)7-12(8-11)16(14,15)10-3-1-2-4-10/h9-10,13H,1-8H2
InChIKeyKVLQSNIHLKUSSQ-UHFFFAOYSA-N
XLogP0.72
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.34
LogP ≤ 50.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-Cyclopropyl-1-(4,4,4-trifluorobutylsulfonyl)azetidin-3-ol
CID 83058919
3-Propyl-1-propylsulfonylazetidin-3-ol
CID 65928746
1-(2,2-Dimethylpropylsulfonyl)-3-propylazetidin-3-ol
CID 65930196
1-Propan-2-ylsulfonyl-3-propylazetidin-3-ol
CID 65930396
1-(Cyclopropylmethylsulfonyl)-3-ethylazetidin-3-ol
CID 65930657
3-Cyclopropyl-1-(2-methylpropylsulfonyl)azetidin-3-ol
CID 65934357
3-Cyclopropyl-1-(oxolan-2-ylmethylsulfonyl)azetidin-3-ol
CID 65934358
2-(3-Cyclopropyl-3-hydroxyazetidin-1-yl)sulfonylbutanenitrile
CID 65934552
3-Cyclopropyl-1-methylsulfonylazetidin-3-ol
CID 65934558
1-Butylsulfonyl-3-cyclopropylazetidin-3-ol
CID 65934759
1-Cyclopropylsulfonyl-3-propan-2-ylazetidin-3-ol
CID 65935141
2-(3-Cyclopropyl-3-hydroxyazetidin-1-yl)sulfonylacetonitrile
CID 65935343

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentylsulfonyl-3-cyclopropylazetidin-3-ol?
The IUPAC name of 1-cyclopentylsulfonyl-3-cyclopropylazetidin-3-ol (CID 105361299) is 1-cyclopentylsulfonyl-3-cyclopropylazetidin-3-ol.
What is the SMILES notation for 1-cyclopentylsulfonyl-3-cyclopropylazetidin-3-ol?
The canonical SMILES for 1-cyclopentylsulfonyl-3-cyclopropylazetidin-3-ol is O=S(=O)(C1CCCC1)N1CC(O)(C2CC2)C1.
What is the InChIKey of 1-cyclopentylsulfonyl-3-cyclopropylazetidin-3-ol?
The InChIKey is KVLQSNIHLKUSSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO3S/c13-11(9-5-6-9)7-12(8-11)16(14,15)10-3-1-2-4-10/h9-10,13H,1-8H2.
What are the key properties of 1-cyclopentylsulfonyl-3-cyclopropylazetidin-3-ol?
1-cyclopentylsulfonyl-3-cyclopropylazetidin-3-ol has a molecular weight of 245.34 g/mol, XLogP of 0.72, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentylsulfonyl-3-cyclopropylazetidin-3-ol is sourced from PubChem (CID 105361299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).