4-nonylsulfonylpyridin-3-amine

C14H24N2O2S — CID 55035695

IUPAC4-nonylsulfonylpyridin-3-amine
SMILESCCCCCCCCCS(=O)(=O)c1ccncc1N
InChIInChI=1S/C14H24N2O2S/c1-2-3-4-5-6-7-8-11-19(17,18)14-9-10-16-12-13(14)15/h9-10,12H,2-8,11,15H2,1H3
InChIKeyIGDBSBHOSAAHGV-UHFFFAOYSA-N
MW284.42 g/mol
LogP3.19
Rot. Bonds9

About 4-nonylsulfonylpyridin-3-amine

4-nonylsulfonylpyridin-3-amine (PubChem CID 55035695) has the molecular formula C14H24N2O2S and a molecular weight of 284.42 g/mol. Its IUPAC name is 4-nonylsulfonylpyridin-3-amine.

Molecular Properties

Compound Name4-nonylsulfonylpyridin-3-amine
PubChem CID55035695
Molecular FormulaC14H24N2O2S
Molecular Weight284.42 g/mol
Exact Mass284.16
IUPAC Name4-nonylsulfonylpyridin-3-amine
SMILESCCCCCCCCCS(=O)(=O)c1ccncc1N
InChIInChI=1S/C14H24N2O2S/c1-2-3-4-5-6-7-8-11-19(17,18)14-9-10-16-12-13(14)15/h9-10,12H,2-8,11,15H2,1H3
InChIKeyIGDBSBHOSAAHGV-UHFFFAOYSA-N
XLogP3.19
TPSA73.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.42
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

5-[(3-amino-4-pyridinyl)sulfonyl]pentanenitrile
CID 62113641
2-dodecylsulfonylaniline
CID 19779074
4-(2-fluoroethylsulfonyl)pyridin-3-amine
CID 80694965
5-fluoro-2-octylsulfonylaniline
CID 81185523
4-methyl-2-nonylsulfonylaniline
CID 81184082
4-(2-pyridin-2-ylethylsulfonyl)pyridin-3-amine
CID 62112810
4-[(3,5-dimethylphenyl)methylsulfonyl]pyridin-3-amine
CID 62112965
3-fluoro-4-hexylsulfonylaniline
CID 81191687
4-hexylsulfonyl-3-methoxyaniline
CID 81206633
4-[[4-(trifluoromethyl)phenyl]methylsulfonyl]pyridin-3-amine
CID 62111812
4-chloro-N-octylpyridine-3-sulfonamide
CID 113337153
4-(2-methylprop-1-enylsulfonyl)pyridin-3-amine
CID 70323652

Frequently Asked Questions

What is the IUPAC name of 4-nonylsulfonylpyridin-3-amine?
The IUPAC name of 4-nonylsulfonylpyridin-3-amine (CID 55035695) is 4-nonylsulfonylpyridin-3-amine.
What is the SMILES notation for 4-nonylsulfonylpyridin-3-amine?
The canonical SMILES for 4-nonylsulfonylpyridin-3-amine is CCCCCCCCCS(=O)(=O)c1ccncc1N.
What is the InChIKey of 4-nonylsulfonylpyridin-3-amine?
The InChIKey is IGDBSBHOSAAHGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O2S/c1-2-3-4-5-6-7-8-11-19(17,18)14-9-10-16-12-13(14)15/h9-10,12H,2-8,11,15H2,1H3.
What are the key properties of 4-nonylsulfonylpyridin-3-amine?
4-nonylsulfonylpyridin-3-amine has a molecular weight of 284.42 g/mol, XLogP of 3.19, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-nonylsulfonylpyridin-3-amine is sourced from PubChem (CID 55035695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).