methanesulfonamide;prop-1-ene;2-[(E)-prop-1-enyl]pyrrolidine

C11H24N2O2S — CID 143261417

IUPACmethanesulfonamide;prop-1-ene;2-[(E)-prop-1-enyl]pyrrolidine
SMILESC/C=C/C1CCCN1.C=CC.CS(N)(=O)=O
InChIInChI=1S/C7H13N.C3H6.CH5NO2S/c1-2-4-7-5-3-6-8-7;1-3-2;1-5(2,3)4/h2,4,7-8H,3,5-6H2,1H3;3H,1H2,2H3;1H3,(H2,2,3,4)/b4-2+;;
InChIKeyVKJZTCUNOQQOBK-IKXJGISXSA-N
MW248.39 g/mol
LogP1.41
Rot. Bonds1

About methanesulfonamide;prop-1-ene;2-[(E)-prop-1-enyl]pyrrolidine

methanesulfonamide;prop-1-ene;2-[(E)-prop-1-enyl]pyrrolidine (PubChem CID 143261417) has the molecular formula C11H24N2O2S and a molecular weight of 248.39 g/mol. Its IUPAC name is methanesulfonamide;prop-1-ene;2-[(E)-prop-1-enyl]pyrrolidine.

Molecular Properties

Compound Namemethanesulfonamide;prop-1-ene;2-[(E)-prop-1-enyl]pyrrolidine
PubChem CID143261417
Molecular FormulaC11H24N2O2S
Molecular Weight248.39 g/mol
Exact Mass248.16
IUPAC Namemethanesulfonamide;prop-1-ene;2-[(E)-prop-1-enyl]pyrrolidine
SMILESC/C=C/C1CCCN1.C=CC.CS(N)(=O)=O
InChIInChI=1S/C7H13N.C3H6.CH5NO2S/c1-2-4-7-5-3-6-8-7;1-3-2;1-5(2,3)4/h2,4,7-8H,3,5-6H2,1H3;3H,1H2,2H3;1H3,(H2,2,3,4)/b4-2+;;
InChIKeyVKJZTCUNOQQOBK-IKXJGISXSA-N
XLogP1.41
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.39
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

6-methyl-N-[[(2R)-1-methylsulfonylpyrrolidin-2-yl]methyl]hept-5-en-2-amine
CID 84596278
1-methylsulfonyl-2-(1,2,3,6-tetrahydropyridin-4-yl)-3,6-dihydro-2H-pyridine
CID 66899353
3-[(2S)-pyrrolidin-2-yl]prop-2-enyl methanesulfonate
CID 91052357
(E)-2-[(2S)-pyrrolidin-1-ium-2-yl]ethenesulfonamide chloride
CID 10751065
(E)-2-[(2S)-pyrrolidin-2-yl]ethenesulfonamide
CID 10751066
N-[2-[cyclohex-2-en-1-yl(methyl)amino]ethyl]methanesulfonamide
CID 56789875
N-cyclohex-3-en-1-yl-1-pyrrolidin-2-ylmethanesulfonamide
CID 65677728
N-prop-2-enyl-N-propyl-1-pyrrolidin-2-ylmethanesulfonamide
CID 81812684
N-propan-2-yl-N-prop-2-enyl-1-pyrrolidin-2-ylmethanesulfonamide
CID 81812802
N-methyl-N-prop-2-enyl-1-pyrrolidin-2-ylmethanesulfonamide
CID 81813106
N-ethyl-N-prop-2-enyl-1-pyrrolidin-2-ylmethanesulfonamide
CID 81813139
6-methyl-N-[(1-methylsulfonylpyrrolidin-3-yl)methyl]hept-5-en-2-amine
CID 84595935

Frequently Asked Questions

What is the IUPAC name of methanesulfonamide;prop-1-ene;2-[(E)-prop-1-enyl]pyrrolidine?
The IUPAC name of methanesulfonamide;prop-1-ene;2-[(E)-prop-1-enyl]pyrrolidine (CID 143261417) is methanesulfonamide;prop-1-ene;2-[(E)-prop-1-enyl]pyrrolidine.
What is the SMILES notation for methanesulfonamide;prop-1-ene;2-[(E)-prop-1-enyl]pyrrolidine?
The canonical SMILES for methanesulfonamide;prop-1-ene;2-[(E)-prop-1-enyl]pyrrolidine is C/C=C/C1CCCN1.C=CC.CS(N)(=O)=O.
What is the InChIKey of methanesulfonamide;prop-1-ene;2-[(E)-prop-1-enyl]pyrrolidine?
The InChIKey is VKJZTCUNOQQOBK-IKXJGISXSA-N. The full InChI is InChI=1S/C7H13N.C3H6.CH5NO2S/c1-2-4-7-5-3-6-8-7;1-3-2;1-5(2,3)4/h2,4,7-8H,3,5-6H2,1H3;3H,1H2,2H3;1H3,(H2,2,3,4)/b4-2+;;.
What are the key properties of methanesulfonamide;prop-1-ene;2-[(E)-prop-1-enyl]pyrrolidine?
methanesulfonamide;prop-1-ene;2-[(E)-prop-1-enyl]pyrrolidine has a molecular weight of 248.39 g/mol, XLogP of 1.41, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methanesulfonamide;prop-1-ene;2-[(E)-prop-1-enyl]pyrrolidine is sourced from PubChem (CID 143261417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).