N-(1-cyclobutylethyl)-3-(propylamino)pyridine-2-sulfonamide

C14H23N3O2S — CID 103307553

IUPACN-(1-cyclobutylethyl)-3-(propylamino)pyridine-2-sulfonamide
SMILESCCCNc1cccnc1S(=O)(=O)NC(C)C1CCC1
InChIInChI=1S/C14H23N3O2S/c1-3-9-15-13-8-5-10-16-14(13)20(18,19)17-11(2)12-6-4-7-12/h5,8,10-12,15,17H,3-4,6-7,9H2,1-2H3
InChIKeySFMMKVLFEPKVIE-UHFFFAOYSA-N
MW297.42 g/mol
LogP2.37
Rot. Bonds7

About N-(1-cyclobutylethyl)-3-(propylamino)pyridine-2-sulfonamide

N-(1-cyclobutylethyl)-3-(propylamino)pyridine-2-sulfonamide (PubChem CID 103307553) has the molecular formula C14H23N3O2S and a molecular weight of 297.42 g/mol. Its IUPAC name is N-(1-cyclobutylethyl)-3-(propylamino)pyridine-2-sulfonamide.

Molecular Properties

Compound NameN-(1-cyclobutylethyl)-3-(propylamino)pyridine-2-sulfonamide
PubChem CID103307553
Molecular FormulaC14H23N3O2S
Molecular Weight297.42 g/mol
Exact Mass297.15
IUPAC NameN-(1-cyclobutylethyl)-3-(propylamino)pyridine-2-sulfonamide
SMILESCCCNc1cccnc1S(=O)(=O)NC(C)C1CCC1
InChIInChI=1S/C14H23N3O2S/c1-3-9-15-13-8-5-10-16-14(13)20(18,19)17-11(2)12-6-4-7-12/h5,8,10-12,15,17H,3-4,6-7,9H2,1-2H3
InChIKeySFMMKVLFEPKVIE-UHFFFAOYSA-N
XLogP2.37
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.42
LogP ≤ 52.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-methylpentan-2-yl)-3-(propylamino)pyridine-2-sulfonamide
CID 103304534
N-methyl-3-(propylamino)pyridine-2-sulfonamide
CID 103303712
N-(3-methylcyclobutyl)-3-(propylamino)pyridine-2-sulfonamide
CID 103307276
3-[[3-(propylamino)-2-pyridinyl]sulfonylamino]butanamide
CID 103307516
3-(propylamino)-N-pyrimidin-2-ylpyridine-2-sulfonamide
CID 103303452
N-ethyl-3-(propylamino)pyridine-2-sulfonamide
CID 103303728
N-(1-methylsulfanylbutan-2-yl)-3-(propylamino)pyridine-2-sulfonamide
CID 103307489
N-(3-ethylpentan-3-yl)-3-(propylamino)pyridine-2-sulfonamide
CID 103306299
N-(4-ethylsulfanylbutan-2-yl)-3-(propylamino)pyridine-2-sulfonamide
CID 103307693
N-(1-methoxypentan-2-yl)-3-(propylamino)pyridine-2-sulfonamide
CID 103306201
N-(2,2-difluoroethyl)-3-(propylamino)pyridine-2-sulfonamide
CID 103306685
3-(propylamino)-N-pyridin-2-ylpyridine-2-sulfonamide
CID 103303743

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclobutylethyl)-3-(propylamino)pyridine-2-sulfonamide?
The IUPAC name of N-(1-cyclobutylethyl)-3-(propylamino)pyridine-2-sulfonamide (CID 103307553) is N-(1-cyclobutylethyl)-3-(propylamino)pyridine-2-sulfonamide.
What is the SMILES notation for N-(1-cyclobutylethyl)-3-(propylamino)pyridine-2-sulfonamide?
The canonical SMILES for N-(1-cyclobutylethyl)-3-(propylamino)pyridine-2-sulfonamide is CCCNc1cccnc1S(=O)(=O)NC(C)C1CCC1.
What is the InChIKey of N-(1-cyclobutylethyl)-3-(propylamino)pyridine-2-sulfonamide?
The InChIKey is SFMMKVLFEPKVIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2S/c1-3-9-15-13-8-5-10-16-14(13)20(18,19)17-11(2)12-6-4-7-12/h5,8,10-12,15,17H,3-4,6-7,9H2,1-2H3.
What are the key properties of N-(1-cyclobutylethyl)-3-(propylamino)pyridine-2-sulfonamide?
N-(1-cyclobutylethyl)-3-(propylamino)pyridine-2-sulfonamide has a molecular weight of 297.42 g/mol, XLogP of 2.37, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclobutylethyl)-3-(propylamino)pyridine-2-sulfonamide is sourced from PubChem (CID 103307553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).