N-[(4S)-4-methoxypyrrolidin-3-yl]cyclopentanesulfonamide

C10H20N2O3S — CID 103832264

IUPACN-[(4S)-4-methoxypyrrolidin-3-yl]cyclopentanesulfonamide
SMILESCO[C@H]1CNCC1NS(=O)(=O)C1CCCC1
InChIInChI=1S/C10H20N2O3S/c1-15-10-7-11-6-9(10)12-16(13,14)8-4-2-3-5-8/h8-12H,2-7H2,1H3/t9?,10-/m0/s1
InChIKeyYOIHWIHSDXPCCB-AXDSSHIGSA-N
MW248.35 g/mol
LogP-0.16
Rot. Bonds4

About N-[(4S)-4-methoxypyrrolidin-3-yl]cyclopentanesulfonamide

N-[(4S)-4-methoxypyrrolidin-3-yl]cyclopentanesulfonamide (PubChem CID 103832264) has the molecular formula C10H20N2O3S and a molecular weight of 248.35 g/mol. Its IUPAC name is N-[(4S)-4-methoxypyrrolidin-3-yl]cyclopentanesulfonamide.

Molecular Properties

Compound NameN-[(4S)-4-methoxypyrrolidin-3-yl]cyclopentanesulfonamide
PubChem CID103832264
Molecular FormulaC10H20N2O3S
Molecular Weight248.35 g/mol
Exact Mass248.12
IUPAC NameN-[(4S)-4-methoxypyrrolidin-3-yl]cyclopentanesulfonamide
SMILESCO[C@H]1CNCC1NS(=O)(=O)C1CCCC1
InChIInChI=1S/C10H20N2O3S/c1-15-10-7-11-6-9(10)12-16(13,14)8-4-2-3-5-8/h8-12H,2-7H2,1H3/t9?,10-/m0/s1
InChIKeyYOIHWIHSDXPCCB-AXDSSHIGSA-N
XLogP-0.16
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.35
LogP ≤ 5-0.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(4S)-4-methoxypyrrolidin-3-yl]cyclopentanesulfonamide?
The IUPAC name of N-[(4S)-4-methoxypyrrolidin-3-yl]cyclopentanesulfonamide (CID 103832264) is N-[(4S)-4-methoxypyrrolidin-3-yl]cyclopentanesulfonamide.
What is the SMILES notation for N-[(4S)-4-methoxypyrrolidin-3-yl]cyclopentanesulfonamide?
The canonical SMILES for N-[(4S)-4-methoxypyrrolidin-3-yl]cyclopentanesulfonamide is CO[C@H]1CNCC1NS(=O)(=O)C1CCCC1.
What is the InChIKey of N-[(4S)-4-methoxypyrrolidin-3-yl]cyclopentanesulfonamide?
The InChIKey is YOIHWIHSDXPCCB-AXDSSHIGSA-N. The full InChI is InChI=1S/C10H20N2O3S/c1-15-10-7-11-6-9(10)12-16(13,14)8-4-2-3-5-8/h8-12H,2-7H2,1H3/t9?,10-/m0/s1.
What are the key properties of N-[(4S)-4-methoxypyrrolidin-3-yl]cyclopentanesulfonamide?
N-[(4S)-4-methoxypyrrolidin-3-yl]cyclopentanesulfonamide has a molecular weight of 248.35 g/mol, XLogP of -0.16, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4S)-4-methoxypyrrolidin-3-yl]cyclopentanesulfonamide is sourced from PubChem (CID 103832264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).