N-[2-(methylamino)ethyl]pyrrolidine-1-sulfonamide

C7H17N3O2S — CID 62657611

IUPACN-[2-(methylamino)ethyl]pyrrolidine-1-sulfonamide
SMILESCNCCNS(=O)(=O)N1CCCC1
InChIInChI=1S/C7H17N3O2S/c1-8-4-5-9-13(11,12)10-6-2-3-7-10/h8-9H,2-7H2,1H3
InChIKeyDMPXSEYMMOURAK-UHFFFAOYSA-N
MW207.30 g/mol
LogP-0.86
Rot. Bonds5

About N-[2-(methylamino)ethyl]pyrrolidine-1-sulfonamide

N-[2-(methylamino)ethyl]pyrrolidine-1-sulfonamide (PubChem CID 62657611) has the molecular formula C7H17N3O2S and a molecular weight of 207.30 g/mol. Its IUPAC name is N-[2-(methylamino)ethyl]pyrrolidine-1-sulfonamide.

Molecular Properties

Compound NameN-[2-(methylamino)ethyl]pyrrolidine-1-sulfonamide
PubChem CID62657611
Molecular FormulaC7H17N3O2S
Molecular Weight207.30 g/mol
Exact Mass207.10
IUPAC NameN-[2-(methylamino)ethyl]pyrrolidine-1-sulfonamide
SMILESCNCCNS(=O)(=O)N1CCCC1
InChIInChI=1S/C7H17N3O2S/c1-8-4-5-9-13(11,12)10-6-2-3-7-10/h8-9H,2-7H2,1H3
InChIKeyDMPXSEYMMOURAK-UHFFFAOYSA-N
XLogP-0.86
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.30
LogP ≤ 5-0.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(methylamino)ethyl]piperazine-1-sulfonamide
CID 117126296
N-(methylaminomethyl)piperidine-1-sulfonamide
CID 117126231
N-[2-(ethylamino)ethyl]azepane-1-sulfonamide
CID 62665481
N-[2-(propylamino)ethyl]azepane-1-sulfonamide
CID 62665322
N-ethylazepane-1-sulfonamide
CID 43213421
N-(2-aminoethyl)piperidine-1-sulfonamide;hydrochloride
CID 119959959
N-[3-(ethylsulfonylamino)propyl]azepane-1-sulfonamide
CID 49459638
N-(3-methoxypropyl)pyrrolidine-1-sulfonamide
CID 110705733
N-[2-methyl-3-(methylamino)propyl]pyrrolidine-1-sulfonamide
CID 115302890
N-(3-chloropropyl)piperidine-1-sulfonamide
CID 43133782
N-(2-methoxyethyl)azetidine-1-sulfonamide
CID 164583733
N-(3-aminopropyl)azepane-1-sulfonamide
CID 28785017

Frequently Asked Questions

What is the IUPAC name of N-[2-(methylamino)ethyl]pyrrolidine-1-sulfonamide?
The IUPAC name of N-[2-(methylamino)ethyl]pyrrolidine-1-sulfonamide (CID 62657611) is N-[2-(methylamino)ethyl]pyrrolidine-1-sulfonamide.
What is the SMILES notation for N-[2-(methylamino)ethyl]pyrrolidine-1-sulfonamide?
The canonical SMILES for N-[2-(methylamino)ethyl]pyrrolidine-1-sulfonamide is CNCCNS(=O)(=O)N1CCCC1.
What is the InChIKey of N-[2-(methylamino)ethyl]pyrrolidine-1-sulfonamide?
The InChIKey is DMPXSEYMMOURAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17N3O2S/c1-8-4-5-9-13(11,12)10-6-2-3-7-10/h8-9H,2-7H2,1H3.
What are the key properties of N-[2-(methylamino)ethyl]pyrrolidine-1-sulfonamide?
N-[2-(methylamino)ethyl]pyrrolidine-1-sulfonamide has a molecular weight of 207.30 g/mol, XLogP of -0.86, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(methylamino)ethyl]pyrrolidine-1-sulfonamide is sourced from PubChem (CID 62657611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).