N-(1-methoxypropan-2-yl)-N-methylpyrrolidine-3-sulfonamide

C9H20N2O3S — CID 65421782

IUPACN-(1-methoxypropan-2-yl)-N-methylpyrrolidine-3-sulfonamide
SMILESCOCC(C)N(C)S(=O)(=O)C1CCNC1
InChIInChI=1S/C9H20N2O3S/c1-8(7-14-3)11(2)15(12,13)9-4-5-10-6-9/h8-10H,4-7H2,1-3H3
InChIKeyAXSYZIJBJBKXSW-UHFFFAOYSA-N
MW236.34 g/mol
LogP-0.36
Rot. Bonds5

About N-(1-methoxypropan-2-yl)-N-methylpyrrolidine-3-sulfonamide

N-(1-methoxypropan-2-yl)-N-methylpyrrolidine-3-sulfonamide (PubChem CID 65421782) has the molecular formula C9H20N2O3S and a molecular weight of 236.34 g/mol. Its IUPAC name is N-(1-methoxypropan-2-yl)-N-methylpyrrolidine-3-sulfonamide.

Molecular Properties

Compound NameN-(1-methoxypropan-2-yl)-N-methylpyrrolidine-3-sulfonamide
PubChem CID65421782
Molecular FormulaC9H20N2O3S
Molecular Weight236.34 g/mol
Exact Mass236.12
IUPAC NameN-(1-methoxypropan-2-yl)-N-methylpyrrolidine-3-sulfonamide
SMILESCOCC(C)N(C)S(=O)(=O)C1CCNC1
InChIInChI=1S/C9H20N2O3S/c1-8(7-14-3)11(2)15(12,13)9-4-5-10-6-9/h8-10H,4-7H2,1-3H3
InChIKeyAXSYZIJBJBKXSW-UHFFFAOYSA-N
XLogP-0.36
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.34
LogP ≤ 5-0.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methoxyethyl)-N-methylpyrrolidine-3-sulfonamide
CID 65421575
N-[1-(2-fluorophenyl)ethyl]-N-methylpyrrolidine-3-sulfonamide
CID 65416386
N,2-dimethyl-3-[methyl(pyrrolidin-3-ylsulfonyl)amino]propanamide
CID 106918335
N-(2-hydroxyethyl)-N-pentan-3-ylpyrrolidine-3-sulfonamide
CID 65420490
N-(1-methoxypropan-2-yl)-N-methylazepan-3-amine
CID 62642462
N-[(4-methoxyphenyl)methyl]-N-methylpyrrolidine-3-sulfonamide
CID 65421567
N-(1-methoxypropan-2-yl)-N-methyl-2-piperidin-4-yloxyacetamide
CID 63876735
2-methylpropyl piperidine-4-sulfonate
CID 177194986
1-methoxy-N-methyl-N-(piperidin-3-ylmethyl)propan-2-amine
CID 61452791
2-[ethyl(pyrrolidin-3-ylsulfonyl)amino]acetamide
CID 103104229
N-methyl-2-[methyl(pyrrolidin-3-ylsulfonyl)amino]acetamide
CID 65420708
1-methoxy-N-(piperidin-3-ylmethyl)-N-propan-2-ylpropan-2-amine
CID 106623955

Frequently Asked Questions

What is the IUPAC name of N-(1-methoxypropan-2-yl)-N-methylpyrrolidine-3-sulfonamide?
The IUPAC name of N-(1-methoxypropan-2-yl)-N-methylpyrrolidine-3-sulfonamide (CID 65421782) is N-(1-methoxypropan-2-yl)-N-methylpyrrolidine-3-sulfonamide.
What is the SMILES notation for N-(1-methoxypropan-2-yl)-N-methylpyrrolidine-3-sulfonamide?
The canonical SMILES for N-(1-methoxypropan-2-yl)-N-methylpyrrolidine-3-sulfonamide is COCC(C)N(C)S(=O)(=O)C1CCNC1.
What is the InChIKey of N-(1-methoxypropan-2-yl)-N-methylpyrrolidine-3-sulfonamide?
The InChIKey is AXSYZIJBJBKXSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O3S/c1-8(7-14-3)11(2)15(12,13)9-4-5-10-6-9/h8-10H,4-7H2,1-3H3.
What are the key properties of N-(1-methoxypropan-2-yl)-N-methylpyrrolidine-3-sulfonamide?
N-(1-methoxypropan-2-yl)-N-methylpyrrolidine-3-sulfonamide has a molecular weight of 236.34 g/mol, XLogP of -0.36, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methoxypropan-2-yl)-N-methylpyrrolidine-3-sulfonamide is sourced from PubChem (CID 65421782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).