3-[(2S)-2-hydroxypropoxy]-N-methylbenzenesulfonamide

Name: 3-[(2S)-2-hydroxypropoxy]-N-methylbenzenesulfonamide — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₁₀H₁₅NO₄S — CID 175061321

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPAC3-[(2S)-2-hydroxypropoxy]-N-methylbenzenesulfonamide

SMILESCNS(=O)(=O)c1cccc(OC[C@H](C)O)c1

InChIInChI=1S/C10H15NO4S/c1-8(12)7-15-9-4-3-5-10(6-9)16(13,14)11-2/h3-6,8,11-12H,7H2,1-2H3/t8-/m0/s1

InChIKeyGTACJLPYAGGGHS-QMMMGPOBSA-N

MW245.30 g/mol

LogP0.35

Rot. Bonds5

About 3-[(2S)-2-hydroxypropoxy]-N-methylbenzenesulfonamide

3-[(2S)-2-hydroxypropoxy]-N-methylbenzenesulfonamide (PubChem CID 175061321) has the molecular formula C₁₀H₁₅NO₄S and a molecular weight of 245.30 g/mol. Its IUPAC name is 3-[(2S)-2-hydroxypropoxy]-N-methylbenzenesulfonamide.

Molecular Properties

Compound Name	3-[(2S)-2-hydroxypropoxy]-N-methylbenzenesulfonamide
PubChem CID	175061321
Molecular Formula	C₁₀H₁₅NO₄S
Molecular Weight	245.30 g/mol
Exact Mass	245.07
IUPAC Name	3-[(2S)-2-hydroxypropoxy]-N-methylbenzenesulfonamide
SMILES	CNS(=O)(=O)c1cccc(OC[C@H](C)O)c1
InChI	InChI=1S/C10H15NO4S/c1-8(12)7-15-9-4-3-5-10(6-9)16(13,14)11-2/h3-6,8,11-12H,7H2,1-2H3/t8-/m0/s1
InChIKey	GTACJLPYAGGGHS-QMMMGPOBSA-N
XLogP	0.35
TPSA	75.63 Å²
H-Bond Donors	2
H-Bond Acceptors	4
Rotatable Bonds	5
Heavy Atoms	16
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	245.30
LogP ≤ 5	0.35
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of 3-[(2S)-2-hydroxypropoxy]-N-methylbenzenesulfonamide?

The IUPAC name of 3-[(2S)-2-hydroxypropoxy]-N-methylbenzenesulfonamide (CID 175061321) is 3-[(2S)-2-hydroxypropoxy]-N-methylbenzenesulfonamide.

What is the SMILES notation for 3-[(2S)-2-hydroxypropoxy]-N-methylbenzenesulfonamide?

The canonical SMILES for 3-[(2S)-2-hydroxypropoxy]-N-methylbenzenesulfonamide is CNS(=O)(=O)c1cccc(OC[C@H](C)O)c1.

What is the InChIKey of 3-[(2S)-2-hydroxypropoxy]-N-methylbenzenesulfonamide?

The InChIKey is GTACJLPYAGGGHS-QMMMGPOBSA-N. The full InChI is InChI=1S/C10H15NO4S/c1-8(12)7-15-9-4-3-5-10(6-9)16(13,14)11-2/h3-6,8,11-12H,7H2,1-2H3/t8-/m0/s1.

What are the key properties of 3-[(2S)-2-hydroxypropoxy]-N-methylbenzenesulfonamide?

3-[(2S)-2-hydroxypropoxy]-N-methylbenzenesulfonamide has a molecular weight of 245.30 g/mol, XLogP of 0.35, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[(2S)-2-hydroxypropoxy]-N-methylbenzenesulfonamide is sourced from PubChem (CID 175061321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Browse: Molecules A–Z · all molecules A–Z · drugs A–Z · protein targets A–Z.

Sources

PubChem CID 175061321 — identifiers, structure, computed properties (public domain)

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