N-(2-methoxypropyl)pyrrolidine-1-sulfonamide

C8H18N2O3S — CID 102697524

IUPACN-(2-methoxypropyl)pyrrolidine-1-sulfonamide
SMILESCOC(C)CNS(=O)(=O)N1CCCC1
InChIInChI=1S/C8H18N2O3S/c1-8(13-2)7-9-14(11,12)10-5-3-4-6-10/h8-9H,3-7H2,1-2H3
InChIKeyMSWQKRGPNSWEIW-UHFFFAOYSA-N
MW222.31 g/mol
LogP-0.05
Rot. Bonds5

About N-(2-methoxypropyl)pyrrolidine-1-sulfonamide

N-(2-methoxypropyl)pyrrolidine-1-sulfonamide (PubChem CID 102697524) has the molecular formula C8H18N2O3S and a molecular weight of 222.31 g/mol. Its IUPAC name is N-(2-methoxypropyl)pyrrolidine-1-sulfonamide.

Molecular Properties

Compound NameN-(2-methoxypropyl)pyrrolidine-1-sulfonamide
PubChem CID102697524
Molecular FormulaC8H18N2O3S
Molecular Weight222.31 g/mol
Exact Mass222.10
IUPAC NameN-(2-methoxypropyl)pyrrolidine-1-sulfonamide
SMILESCOC(C)CNS(=O)(=O)N1CCCC1
InChIInChI=1S/C8H18N2O3S/c1-8(13-2)7-9-14(11,12)10-5-3-4-6-10/h8-9H,3-7H2,1-2H3
InChIKeyMSWQKRGPNSWEIW-UHFFFAOYSA-N
XLogP-0.05
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.31
LogP ≤ 5-0.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-methoxyethyl)pyrrolidine-1-sulfonamide
CID 60724649
3-Propan-2-yloxypyrrolidine-1-sulfonamide
CID 68267293
N-(2-methoxyethyl)pyrrolidine-1-sulfinamide
CID 155587263
2-methoxy-N-pyrrolidin-1-ylsulfanylethanamine
CID 164583724
2-methoxy-N-pyrrolidin-1-ylsulfanylethanamine;dihydrate
CID 170732556
Methane;3-methoxypyrrolidine-1-sulfonamide
CID 177012106
N-(2-hydroxypropyl)pyrrolidine-1-sulfonamide
CID 43502415
N-(3-aminopropyl)-N-(2-methoxyethyl)pyrrolidine-1-sulfonamide
CID 55171321
(4-Pyrrolidin-1-ylsulfonylmorpholin-2-yl)methanamine
CID 61338565
N-(2-amino-3-methoxypropyl)-N-methylpyrrolidine-1-sulfonamide
CID 63765639
N-[2-(2-aminoethoxy)ethyl]pyrrolidine-1-sulfonamide
CID 63767345
N-methyl-N-(morpholin-2-ylmethyl)pyrrolidine-1-sulfonamide
CID 81685510

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxypropyl)pyrrolidine-1-sulfonamide?
The IUPAC name of N-(2-methoxypropyl)pyrrolidine-1-sulfonamide (CID 102697524) is N-(2-methoxypropyl)pyrrolidine-1-sulfonamide.
What is the SMILES notation for N-(2-methoxypropyl)pyrrolidine-1-sulfonamide?
The canonical SMILES for N-(2-methoxypropyl)pyrrolidine-1-sulfonamide is COC(C)CNS(=O)(=O)N1CCCC1.
What is the InChIKey of N-(2-methoxypropyl)pyrrolidine-1-sulfonamide?
The InChIKey is MSWQKRGPNSWEIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O3S/c1-8(13-2)7-9-14(11,12)10-5-3-4-6-10/h8-9H,3-7H2,1-2H3.
What are the key properties of N-(2-methoxypropyl)pyrrolidine-1-sulfonamide?
N-(2-methoxypropyl)pyrrolidine-1-sulfonamide has a molecular weight of 222.31 g/mol, XLogP of -0.05, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxypropyl)pyrrolidine-1-sulfonamide is sourced from PubChem (CID 102697524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).