1-(oxolan-3-yl)-N-(2-pyrrolidin-3-ylethyl)methanesulfonamide;hydrochloride

C11H23ClN2O3S — CID 119976903

IUPAC1-(oxolan-3-yl)-N-(2-pyrrolidin-3-ylethyl)methanesulfonamide;hydrochloride
SMILESCl.O=S(=O)(CC1CCOC1)NCCC1CCNC1
InChIInChI=1S/C11H22N2O3S.ClH/c14-17(15,9-11-3-6-16-8-11)13-5-2-10-1-4-12-7-10;/h10-13H,1-9H2;1H
InChIKeyMHVDORNMHJETHC-UHFFFAOYSA-N
MW298.84 g/mol
LogP0.36
Rot. Bonds6

About 1-(oxolan-3-yl)-N-(2-pyrrolidin-3-ylethyl)methanesulfonamide;hydrochloride

1-(oxolan-3-yl)-N-(2-pyrrolidin-3-ylethyl)methanesulfonamide;hydrochloride (PubChem CID 119976903) has the molecular formula C11H23ClN2O3S and a molecular weight of 298.84 g/mol. Its IUPAC name is 1-(oxolan-3-yl)-N-(2-pyrrolidin-3-ylethyl)methanesulfonamide;hydrochloride.

Molecular Properties

Compound Name1-(oxolan-3-yl)-N-(2-pyrrolidin-3-ylethyl)methanesulfonamide;hydrochloride
PubChem CID119976903
Molecular FormulaC11H23ClN2O3S
Molecular Weight298.84 g/mol
Exact Mass298.11
IUPAC Name1-(oxolan-3-yl)-N-(2-pyrrolidin-3-ylethyl)methanesulfonamide;hydrochloride
SMILESCl.O=S(=O)(CC1CCOC1)NCCC1CCNC1
InChIInChI=1S/C11H22N2O3S.ClH/c14-17(15,9-11-3-6-16-8-11)13-5-2-10-1-4-12-7-10;/h10-13H,1-9H2;1H
InChIKeyMHVDORNMHJETHC-UHFFFAOYSA-N
XLogP0.36
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.84
LogP ≤ 50.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

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N-(2-pyrrolidin-3-ylethyl)butane-1-sulfonamide
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N-[2-(4-aminophenyl)ethyl]-1-(oxolan-3-yl)methanesulfonamide;hydrochloride
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N-(oxolan-3-ylmethyl)-1-pyrrolidin-3-ylmethanamine
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N-(2-pyrrolidin-3-ylethylsulfamoyl)cyclopropanamine
CID 114810747
N-[(3-methylpiperidin-3-yl)methyl]-1-(oxolan-3-yl)methanesulfonamide;hydrochloride
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Frequently Asked Questions

What is the IUPAC name of 1-(oxolan-3-yl)-N-(2-pyrrolidin-3-ylethyl)methanesulfonamide;hydrochloride?
The IUPAC name of 1-(oxolan-3-yl)-N-(2-pyrrolidin-3-ylethyl)methanesulfonamide;hydrochloride (CID 119976903) is 1-(oxolan-3-yl)-N-(2-pyrrolidin-3-ylethyl)methanesulfonamide;hydrochloride.
What is the SMILES notation for 1-(oxolan-3-yl)-N-(2-pyrrolidin-3-ylethyl)methanesulfonamide;hydrochloride?
The canonical SMILES for 1-(oxolan-3-yl)-N-(2-pyrrolidin-3-ylethyl)methanesulfonamide;hydrochloride is Cl.O=S(=O)(CC1CCOC1)NCCC1CCNC1.
What is the InChIKey of 1-(oxolan-3-yl)-N-(2-pyrrolidin-3-ylethyl)methanesulfonamide;hydrochloride?
The InChIKey is MHVDORNMHJETHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O3S.ClH/c14-17(15,9-11-3-6-16-8-11)13-5-2-10-1-4-12-7-10;/h10-13H,1-9H2;1H.
What are the key properties of 1-(oxolan-3-yl)-N-(2-pyrrolidin-3-ylethyl)methanesulfonamide;hydrochloride?
1-(oxolan-3-yl)-N-(2-pyrrolidin-3-ylethyl)methanesulfonamide;hydrochloride has a molecular weight of 298.84 g/mol, XLogP of 0.36, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(oxolan-3-yl)-N-(2-pyrrolidin-3-ylethyl)methanesulfonamide;hydrochloride is sourced from PubChem (CID 119976903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).