N-pyrrolidin-2-ylmorpholine-4-sulfonamide

C8H17N3O3S — CID 117126254

IUPACN-pyrrolidin-2-ylmorpholine-4-sulfonamide
SMILESO=S(=O)(NC1CCCN1)N1CCOCC1
InChIInChI=1S/C8H17N3O3S/c12-15(13,10-8-2-1-3-9-8)11-4-6-14-7-5-11/h8-10H,1-7H2
InChIKeySURUYAQDVVJMBN-UHFFFAOYSA-N
MW235.31 g/mol
LogP-1.14
Rot. Bonds3

About N-pyrrolidin-2-ylmorpholine-4-sulfonamide

N-pyrrolidin-2-ylmorpholine-4-sulfonamide (PubChem CID 117126254) has the molecular formula C8H17N3O3S and a molecular weight of 235.31 g/mol. Its IUPAC name is N-pyrrolidin-2-ylmorpholine-4-sulfonamide.

Molecular Properties

Compound NameN-pyrrolidin-2-ylmorpholine-4-sulfonamide
PubChem CID117126254
Molecular FormulaC8H17N3O3S
Molecular Weight235.31 g/mol
Exact Mass235.10
IUPAC NameN-pyrrolidin-2-ylmorpholine-4-sulfonamide
SMILESO=S(=O)(NC1CCCN1)N1CCOCC1
InChIInChI=1S/C8H17N3O3S/c12-15(13,10-8-2-1-3-9-8)11-4-6-14-7-5-11/h8-10H,1-7H2
InChIKeySURUYAQDVVJMBN-UHFFFAOYSA-N
XLogP-1.14
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.31
LogP ≤ 5-1.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-(Pyrrolidin-2-yl)morpholine
CID 17888418
3-Pyrrolidin-1-ylmorpholine
CID 53987424
1-Morpholin-4-ylsulfonylpyrrolidin-2-amine
CID 43210459
N-(morpholin-2-ylmethyl)pyrrolidine-1-sulfonamide
CID 43602772
N-pyrrolidin-3-ylmorpholine-4-sulfonamide
CID 43602885
(4-Pyrrolidin-1-ylsulfonylmorpholin-2-yl)methanamine
CID 61338565
(1-Morpholin-4-ylsulfonylpyrrolidin-3-yl)methanamine
CID 62061815
N-methyl-1-(1-morpholin-4-ylsulfonylpyrrolidin-3-yl)methanamine
CID 63264058
4-Pyrrolidin-1-ylsulfonylmorpholin-3-amine
CID 65547415
(3R)-3-(Pyrrolidin-1-YL)morpholine
CID 71773528
(3S)-3-pyrrolidin-1-ylmorpholine
CID 71773529
N-[(3S)-pyrrolidin-3-yl]morpholine-4-sulfonamide
CID 79685144

Frequently Asked Questions

What is the IUPAC name of N-pyrrolidin-2-ylmorpholine-4-sulfonamide?
The IUPAC name of N-pyrrolidin-2-ylmorpholine-4-sulfonamide (CID 117126254) is N-pyrrolidin-2-ylmorpholine-4-sulfonamide.
What is the SMILES notation for N-pyrrolidin-2-ylmorpholine-4-sulfonamide?
The canonical SMILES for N-pyrrolidin-2-ylmorpholine-4-sulfonamide is O=S(=O)(NC1CCCN1)N1CCOCC1.
What is the InChIKey of N-pyrrolidin-2-ylmorpholine-4-sulfonamide?
The InChIKey is SURUYAQDVVJMBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N3O3S/c12-15(13,10-8-2-1-3-9-8)11-4-6-14-7-5-11/h8-10H,1-7H2.
What are the key properties of N-pyrrolidin-2-ylmorpholine-4-sulfonamide?
N-pyrrolidin-2-ylmorpholine-4-sulfonamide has a molecular weight of 235.31 g/mol, XLogP of -1.14, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-pyrrolidin-2-ylmorpholine-4-sulfonamide is sourced from PubChem (CID 117126254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).