1-(cyclopropylmethylsulfonyl)pyrrolidin-3-ol

C8H15NO3S — CID 64987623

IUPAC1-(cyclopropylmethylsulfonyl)pyrrolidin-3-ol
SMILESO=S(=O)(CC1CC1)N1CCC(O)C1
InChIInChI=1S/C8H15NO3S/c10-8-3-4-9(5-8)13(11,12)6-7-1-2-7/h7-8,10H,1-6H2
InChIKeyWRXIUAMDPKFEDS-UHFFFAOYSA-N
MW205.28 g/mol
LogP-0.21
Rot. Bonds3

About 1-(cyclopropylmethylsulfonyl)pyrrolidin-3-ol

1-(cyclopropylmethylsulfonyl)pyrrolidin-3-ol (PubChem CID 64987623) has the molecular formula C8H15NO3S and a molecular weight of 205.28 g/mol. Its IUPAC name is 1-(cyclopropylmethylsulfonyl)pyrrolidin-3-ol.

Molecular Properties

Compound Name1-(cyclopropylmethylsulfonyl)pyrrolidin-3-ol
PubChem CID64987623
Molecular FormulaC8H15NO3S
Molecular Weight205.28 g/mol
Exact Mass205.08
IUPAC Name1-(cyclopropylmethylsulfonyl)pyrrolidin-3-ol
SMILESO=S(=O)(CC1CC1)N1CCC(O)C1
InChIInChI=1S/C8H15NO3S/c10-8-3-4-9(5-8)13(11,12)6-7-1-2-7/h7-8,10H,1-6H2
InChIKeyWRXIUAMDPKFEDS-UHFFFAOYSA-N
XLogP-0.21
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.28
LogP ≤ 5-0.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylmethylsulfonyl)pyrrolidin-3-ol?
The IUPAC name of 1-(cyclopropylmethylsulfonyl)pyrrolidin-3-ol (CID 64987623) is 1-(cyclopropylmethylsulfonyl)pyrrolidin-3-ol.
What is the SMILES notation for 1-(cyclopropylmethylsulfonyl)pyrrolidin-3-ol?
The canonical SMILES for 1-(cyclopropylmethylsulfonyl)pyrrolidin-3-ol is O=S(=O)(CC1CC1)N1CCC(O)C1.
What is the InChIKey of 1-(cyclopropylmethylsulfonyl)pyrrolidin-3-ol?
The InChIKey is WRXIUAMDPKFEDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO3S/c10-8-3-4-9(5-8)13(11,12)6-7-1-2-7/h7-8,10H,1-6H2.
What are the key properties of 1-(cyclopropylmethylsulfonyl)pyrrolidin-3-ol?
1-(cyclopropylmethylsulfonyl)pyrrolidin-3-ol has a molecular weight of 205.28 g/mol, XLogP of -0.21, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropylmethylsulfonyl)pyrrolidin-3-ol is sourced from PubChem (CID 64987623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).