N-[(2R)-1-aminopropan-2-yl]-6-methylpyridine-3-sulfonamide

C9H15N3O2S — CID 120712871

IUPACN-[(2R)-1-aminopropan-2-yl]-6-methylpyridine-3-sulfonamide
SMILESCc1ccc(S(=O)(=O)N[C@H](C)CN)cn1
InChIInChI=1S/C9H15N3O2S/c1-7-3-4-9(6-11-7)15(13,14)12-8(2)5-10/h3-4,6,8,12H,5,10H2,1-2H3/t8-/m1/s1
InChIKeyRUQQINHFXFRVGZ-MRVPVSSYSA-N
MW229.31 g/mol
LogP0.02
Rot. Bonds4

About N-[(2R)-1-aminopropan-2-yl]-6-methylpyridine-3-sulfonamide

N-[(2R)-1-aminopropan-2-yl]-6-methylpyridine-3-sulfonamide (PubChem CID 120712871) has the molecular formula C9H15N3O2S and a molecular weight of 229.31 g/mol. Its IUPAC name is N-[(2R)-1-aminopropan-2-yl]-6-methylpyridine-3-sulfonamide.

Molecular Properties

Compound NameN-[(2R)-1-aminopropan-2-yl]-6-methylpyridine-3-sulfonamide
PubChem CID120712871
Molecular FormulaC9H15N3O2S
Molecular Weight229.31 g/mol
Exact Mass229.09
IUPAC NameN-[(2R)-1-aminopropan-2-yl]-6-methylpyridine-3-sulfonamide
SMILESCc1ccc(S(=O)(=O)N[C@H](C)CN)cn1
InChIInChI=1S/C9H15N3O2S/c1-7-3-4-9(6-11-7)15(13,14)12-8(2)5-10/h3-4,6,8,12H,5,10H2,1-2H3/t8-/m1/s1
InChIKeyRUQQINHFXFRVGZ-MRVPVSSYSA-N
XLogP0.02
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.31
LogP ≤ 50.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(2R)-1-aminopropan-2-yl]-6-methylpyridine-3-sulfonamide?
The IUPAC name of N-[(2R)-1-aminopropan-2-yl]-6-methylpyridine-3-sulfonamide (CID 120712871) is N-[(2R)-1-aminopropan-2-yl]-6-methylpyridine-3-sulfonamide.
What is the SMILES notation for N-[(2R)-1-aminopropan-2-yl]-6-methylpyridine-3-sulfonamide?
The canonical SMILES for N-[(2R)-1-aminopropan-2-yl]-6-methylpyridine-3-sulfonamide is Cc1ccc(S(=O)(=O)N[C@H](C)CN)cn1.
What is the InChIKey of N-[(2R)-1-aminopropan-2-yl]-6-methylpyridine-3-sulfonamide?
The InChIKey is RUQQINHFXFRVGZ-MRVPVSSYSA-N. The full InChI is InChI=1S/C9H15N3O2S/c1-7-3-4-9(6-11-7)15(13,14)12-8(2)5-10/h3-4,6,8,12H,5,10H2,1-2H3/t8-/m1/s1.
What are the key properties of N-[(2R)-1-aminopropan-2-yl]-6-methylpyridine-3-sulfonamide?
N-[(2R)-1-aminopropan-2-yl]-6-methylpyridine-3-sulfonamide has a molecular weight of 229.31 g/mol, XLogP of 0.02, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-1-aminopropan-2-yl]-6-methylpyridine-3-sulfonamide is sourced from PubChem (CID 120712871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).