N-(oxolan-3-ylmethyl)pyrrolidine-3-sulfonamide

C9H18N2O3S — CID 65418756

IUPACN-(oxolan-3-ylmethyl)pyrrolidine-3-sulfonamide
SMILESO=S(=O)(NCC1CCOC1)C1CCNC1
InChIInChI=1S/C9H18N2O3S/c12-15(13,9-1-3-10-6-9)11-5-8-2-4-14-7-8/h8-11H,1-7H2
InChIKeyKGUAEINWYJVEKE-UHFFFAOYSA-N
MW234.32 g/mol
LogP-0.70
Rot. Bonds4

About N-(oxolan-3-ylmethyl)pyrrolidine-3-sulfonamide

N-(oxolan-3-ylmethyl)pyrrolidine-3-sulfonamide (PubChem CID 65418756) has the molecular formula C9H18N2O3S and a molecular weight of 234.32 g/mol. Its IUPAC name is N-(oxolan-3-ylmethyl)pyrrolidine-3-sulfonamide.

Molecular Properties

Compound NameN-(oxolan-3-ylmethyl)pyrrolidine-3-sulfonamide
PubChem CID65418756
Molecular FormulaC9H18N2O3S
Molecular Weight234.32 g/mol
Exact Mass234.10
IUPAC NameN-(oxolan-3-ylmethyl)pyrrolidine-3-sulfonamide
SMILESO=S(=O)(NCC1CCOC1)C1CCNC1
InChIInChI=1S/C9H18N2O3S/c12-15(13,9-1-3-10-6-9)11-5-8-2-4-14-7-8/h8-11H,1-7H2
InChIKeyKGUAEINWYJVEKE-UHFFFAOYSA-N
XLogP-0.70
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.32
LogP ≤ 5-0.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]methyl]oxolane-3-sulfonamide
CID 127332185
N-[[1-(oxolan-3-ylsulfonyl)pyrrolidin-3-yl]methyl]ethenesulfonamide
CID 146210451
N-[[(3R)-1-(oxolan-3-ylsulfonyl)pyrrolidin-3-yl]methyl]ethenesulfonamide
CID 146210589
1,1-dioxo-N-(oxolan-3-ylmethyl)thiolan-3-amine
CID 43191002
2-(Oxolan-3-ylmethylamino)ethanesulfonamide
CID 43551821
N-(oxolan-3-ylmethyl)-1-piperidin-3-ylmethanesulfonamide
CID 55119441
N-(oxolan-3-ylmethyl)-3-(propan-2-ylamino)propane-1-sulfonamide
CID 55119442
3-[ethyl(oxolan-3-ylmethyl)amino]-N-methylpropane-1-sulfonamide
CID 56805796
2-methylsulfonyl-N-(oxolan-3-ylmethyl)ethanamine
CID 60921048
N-ethyl-N-[3-(oxolan-3-ylmethylamino)propyl]methanesulfonamide
CID 61013538
3-methylsulfonyl-N-(oxolan-3-ylmethyl)propan-1-amine
CID 61019969
2-ethylsulfonyl-N-(oxolan-3-ylmethyl)ethanamine
CID 61039071

Frequently Asked Questions

What is the IUPAC name of N-(oxolan-3-ylmethyl)pyrrolidine-3-sulfonamide?
The IUPAC name of N-(oxolan-3-ylmethyl)pyrrolidine-3-sulfonamide (CID 65418756) is N-(oxolan-3-ylmethyl)pyrrolidine-3-sulfonamide.
What is the SMILES notation for N-(oxolan-3-ylmethyl)pyrrolidine-3-sulfonamide?
The canonical SMILES for N-(oxolan-3-ylmethyl)pyrrolidine-3-sulfonamide is O=S(=O)(NCC1CCOC1)C1CCNC1.
What is the InChIKey of N-(oxolan-3-ylmethyl)pyrrolidine-3-sulfonamide?
The InChIKey is KGUAEINWYJVEKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O3S/c12-15(13,9-1-3-10-6-9)11-5-8-2-4-14-7-8/h8-11H,1-7H2.
What are the key properties of N-(oxolan-3-ylmethyl)pyrrolidine-3-sulfonamide?
N-(oxolan-3-ylmethyl)pyrrolidine-3-sulfonamide has a molecular weight of 234.32 g/mol, XLogP of -0.70, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(oxolan-3-ylmethyl)pyrrolidine-3-sulfonamide is sourced from PubChem (CID 65418756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).