6-(ethylamino)-N-[(2-methylphenyl)methyl]pyridine-3-sulfonamide

C15H19N3O2S — CID 62147749

IUPAC6-(ethylamino)-N-[(2-methylphenyl)methyl]pyridine-3-sulfonamide
SMILESCCNc1ccc(S(=O)(=O)NCc2ccccc2C)cn1
InChIInChI=1S/C15H19N3O2S/c1-3-16-15-9-8-14(11-17-15)21(19,20)18-10-13-7-5-4-6-12(13)2/h4-9,11,18H,3,10H2,1-2H3,(H,16,17)
InChIKeyDEEFTXZMLVUIFL-UHFFFAOYSA-N
MW305.40 g/mol
LogP2.30
Rot. Bonds6

About 6-(ethylamino)-N-[(2-methylphenyl)methyl]pyridine-3-sulfonamide

6-(ethylamino)-N-[(2-methylphenyl)methyl]pyridine-3-sulfonamide (PubChem CID 62147749) has the molecular formula C15H19N3O2S and a molecular weight of 305.40 g/mol. Its IUPAC name is 6-(ethylamino)-N-[(2-methylphenyl)methyl]pyridine-3-sulfonamide.

Molecular Properties

Compound Name6-(ethylamino)-N-[(2-methylphenyl)methyl]pyridine-3-sulfonamide
PubChem CID62147749
Molecular FormulaC15H19N3O2S
Molecular Weight305.40 g/mol
Exact Mass305.12
IUPAC Name6-(ethylamino)-N-[(2-methylphenyl)methyl]pyridine-3-sulfonamide
SMILESCCNc1ccc(S(=O)(=O)NCc2ccccc2C)cn1
InChIInChI=1S/C15H19N3O2S/c1-3-16-15-9-8-14(11-17-15)21(19,20)18-10-13-7-5-4-6-12(13)2/h4-9,11,18H,3,10H2,1-2H3,(H,16,17)
InChIKeyDEEFTXZMLVUIFL-UHFFFAOYSA-N
XLogP2.30
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.40
LogP ≤ 52.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-(ethylamino)-N-(2-methylphenyl)pyridine-3-sulfonamide
CID 62143880
6-cyano-N-[(2-methylphenyl)methyl]pyridine-3-sulfonamide
CID 115602469
6-(ethylamino)-N-(pyridin-4-ylmethyl)pyridine-3-sulfonamide
CID 62150311
6-(ethylamino)-N-methylpyridine-3-sulfonamide
CID 62150384
N-[(4-bromophenyl)methyl]-6-(ethylamino)pyridine-3-sulfonamide
CID 62150157
6-(methylamino)-N-[2-(2-methylphenyl)ethyl]pyridine-3-sulfonamide
CID 79755229
N-[(2-methylphenyl)methyl]pyridine-3-sulfonamide
CID 110865640
N-(2,2-dimethylbutyl)-6-(ethylamino)pyridine-3-sulfonamide
CID 103464350
N-benzyl-6-(propylamino)pyridine-3-sulfonamide
CID 62148374
6-(ethylamino)-N-[(1-methylimidazol-2-yl)methyl]pyridine-3-sulfonamide
CID 63296118
3-amino-4-ethyl-N-[(2-methylphenyl)methyl]benzenesulfonamide
CID 60904241
6-(ethylamino)-N-(2-methoxyethyl)pyridine-3-sulfonamide
CID 62148459

Frequently Asked Questions

What is the IUPAC name of 6-(ethylamino)-N-[(2-methylphenyl)methyl]pyridine-3-sulfonamide?
The IUPAC name of 6-(ethylamino)-N-[(2-methylphenyl)methyl]pyridine-3-sulfonamide (CID 62147749) is 6-(ethylamino)-N-[(2-methylphenyl)methyl]pyridine-3-sulfonamide.
What is the SMILES notation for 6-(ethylamino)-N-[(2-methylphenyl)methyl]pyridine-3-sulfonamide?
The canonical SMILES for 6-(ethylamino)-N-[(2-methylphenyl)methyl]pyridine-3-sulfonamide is CCNc1ccc(S(=O)(=O)NCc2ccccc2C)cn1.
What is the InChIKey of 6-(ethylamino)-N-[(2-methylphenyl)methyl]pyridine-3-sulfonamide?
The InChIKey is DEEFTXZMLVUIFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2S/c1-3-16-15-9-8-14(11-17-15)21(19,20)18-10-13-7-5-4-6-12(13)2/h4-9,11,18H,3,10H2,1-2H3,(H,16,17).
What are the key properties of 6-(ethylamino)-N-[(2-methylphenyl)methyl]pyridine-3-sulfonamide?
6-(ethylamino)-N-[(2-methylphenyl)methyl]pyridine-3-sulfonamide has a molecular weight of 305.40 g/mol, XLogP of 2.30, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(ethylamino)-N-[(2-methylphenyl)methyl]pyridine-3-sulfonamide is sourced from PubChem (CID 62147749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).