N-(3-methylcyclobutyl)-3-(propylamino)pyridine-2-sulfonamide

C13H21N3O2S — CID 103307276

IUPACN-(3-methylcyclobutyl)-3-(propylamino)pyridine-2-sulfonamide
SMILESCCCNc1cccnc1S(=O)(=O)NC1CC(C)C1
InChIInChI=1S/C13H21N3O2S/c1-3-6-14-12-5-4-7-15-13(12)19(17,18)16-11-8-10(2)9-11/h4-5,7,10-11,14,16H,3,6,8-9H2,1-2H3
InChIKeyQNYYMLPTBYWYCS-UHFFFAOYSA-N
MW283.40 g/mol
LogP1.98
Rot. Bonds6

About N-(3-methylcyclobutyl)-3-(propylamino)pyridine-2-sulfonamide

N-(3-methylcyclobutyl)-3-(propylamino)pyridine-2-sulfonamide (PubChem CID 103307276) has the molecular formula C13H21N3O2S and a molecular weight of 283.40 g/mol. Its IUPAC name is N-(3-methylcyclobutyl)-3-(propylamino)pyridine-2-sulfonamide.

Molecular Properties

Compound NameN-(3-methylcyclobutyl)-3-(propylamino)pyridine-2-sulfonamide
PubChem CID103307276
Molecular FormulaC13H21N3O2S
Molecular Weight283.40 g/mol
Exact Mass283.14
IUPAC NameN-(3-methylcyclobutyl)-3-(propylamino)pyridine-2-sulfonamide
SMILESCCCNc1cccnc1S(=O)(=O)NC1CC(C)C1
InChIInChI=1S/C13H21N3O2S/c1-3-6-14-12-5-4-7-15-13(12)19(17,18)16-11-8-10(2)9-11/h4-5,7,10-11,14,16H,3,6,8-9H2,1-2H3
InChIKeyQNYYMLPTBYWYCS-UHFFFAOYSA-N
XLogP1.98
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.40
LogP ≤ 51.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3,5-dimethylcyclohexyl)-3-(methylamino)pyridine-2-sulfonamide
CID 103306280
N-methyl-3-(propylamino)pyridine-2-sulfonamide
CID 103303712
N-cyclopropyl-3-(ethylamino)pyridine-2-sulfonamide
CID 103303691
3-(propylamino)-N-pyrimidin-2-ylpyridine-2-sulfonamide
CID 103303452
N-ethyl-3-(propylamino)pyridine-2-sulfonamide
CID 103303728
N-(1-cyclobutylethyl)-3-(propylamino)pyridine-2-sulfonamide
CID 103307553
2-(4-methylpiperidin-1-yl)sulfonyl-N-propylpyridin-3-amine
CID 103303589
N-(3-ethylpentan-3-yl)-3-(propylamino)pyridine-2-sulfonamide
CID 103306299
3-(propylamino)-N-pyridin-2-ylpyridine-2-sulfonamide
CID 103303743
3-(ethylamino)-N-(thian-4-yl)pyridine-2-sulfonamide
CID 103307536
3-(ethylamino)-N-(oxan-3-yl)pyridine-2-sulfonamide
CID 103305993
N-(2,2-difluoroethyl)-3-(propylamino)pyridine-2-sulfonamide
CID 103306685

Frequently Asked Questions

What is the IUPAC name of N-(3-methylcyclobutyl)-3-(propylamino)pyridine-2-sulfonamide?
The IUPAC name of N-(3-methylcyclobutyl)-3-(propylamino)pyridine-2-sulfonamide (CID 103307276) is N-(3-methylcyclobutyl)-3-(propylamino)pyridine-2-sulfonamide.
What is the SMILES notation for N-(3-methylcyclobutyl)-3-(propylamino)pyridine-2-sulfonamide?
The canonical SMILES for N-(3-methylcyclobutyl)-3-(propylamino)pyridine-2-sulfonamide is CCCNc1cccnc1S(=O)(=O)NC1CC(C)C1.
What is the InChIKey of N-(3-methylcyclobutyl)-3-(propylamino)pyridine-2-sulfonamide?
The InChIKey is QNYYMLPTBYWYCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O2S/c1-3-6-14-12-5-4-7-15-13(12)19(17,18)16-11-8-10(2)9-11/h4-5,7,10-11,14,16H,3,6,8-9H2,1-2H3.
What are the key properties of N-(3-methylcyclobutyl)-3-(propylamino)pyridine-2-sulfonamide?
N-(3-methylcyclobutyl)-3-(propylamino)pyridine-2-sulfonamide has a molecular weight of 283.40 g/mol, XLogP of 1.98, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylcyclobutyl)-3-(propylamino)pyridine-2-sulfonamide is sourced from PubChem (CID 103307276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).