N-[[2-(1-methylpyrazol-4-yl)-3-pyridinyl]methyl]pyridine-3-sulfonamide

C15H15N5O2S — CID 122275551

IUPACN-[[2-(1-methylpyrazol-4-yl)-3-pyridinyl]methyl]pyridine-3-sulfonamide
SMILESCn1cc(-c2ncccc2CNS(=O)(=O)c2cccnc2)cn1
InChIInChI=1S/C15H15N5O2S/c1-20-11-13(8-18-20)15-12(4-2-7-17-15)9-19-23(21,22)14-5-3-6-16-10-14/h2-8,10-11,19H,9H2,1H3
InChIKeyFMGDPJMKAVSKNX-UHFFFAOYSA-N
MW329.39 g/mol
LogP1.36
Rot. Bonds5

About N-[[2-(1-methylpyrazol-4-yl)-3-pyridinyl]methyl]pyridine-3-sulfonamide

N-[[2-(1-methylpyrazol-4-yl)-3-pyridinyl]methyl]pyridine-3-sulfonamide (PubChem CID 122275551) has the molecular formula C15H15N5O2S and a molecular weight of 329.39 g/mol. Its IUPAC name is N-[[2-(1-methylpyrazol-4-yl)-3-pyridinyl]methyl]pyridine-3-sulfonamide.

Molecular Properties

Compound NameN-[[2-(1-methylpyrazol-4-yl)-3-pyridinyl]methyl]pyridine-3-sulfonamide
PubChem CID122275551
Molecular FormulaC15H15N5O2S
Molecular Weight329.39 g/mol
Exact Mass329.09
IUPAC NameN-[[2-(1-methylpyrazol-4-yl)-3-pyridinyl]methyl]pyridine-3-sulfonamide
SMILESCn1cc(-c2ncccc2CNS(=O)(=O)c2cccnc2)cn1
InChIInChI=1S/C15H15N5O2S/c1-20-11-13(8-18-20)15-12(4-2-7-17-15)9-19-23(21,22)14-5-3-6-16-10-14/h2-8,10-11,19H,9H2,1H3
InChIKeyFMGDPJMKAVSKNX-UHFFFAOYSA-N
XLogP1.36
TPSA89.77 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.39
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-methyl-N-[[2-(1-methylpyrazol-4-yl)-3-pyridinyl]methyl]benzenesulfonamide
CID 121022847
3,5-difluoro-N-[[2-(1-methylpyrazol-4-yl)-3-pyridinyl]methyl]benzenesulfonamide
CID 122275612
4-fluoro-N-[[2-(1-methylpyrazol-4-yl)-3-pyridinyl]methyl]benzenesulfonamide
CID 122275553
4-acetyl-N-[[2-(1-methylpyrazol-4-yl)-3-pyridinyl]methyl]benzenesulfonamide
CID 122275576
1,2-dimethyl-N-[[2-(1-methylpyrazol-4-yl)-3-pyridinyl]methyl]imidazole-4-sulfonamide
CID 122275647
5-bromo-N-[[2-(1-methylpyrazol-4-yl)-3-pyridinyl]methyl]thiophene-2-sulfonamide
CID 122275603
1-[[2-(1-methylpyrazol-4-yl)-3-pyridinyl]methyl]-3-(pyridin-3-ylmethyl)urea
CID 122275480
N-[(2-methylphenyl)methyl]pyridine-3-sulfonamide
CID 110865640
1-[[2-(1-methylpyrazol-4-yl)-3-pyridinyl]methyl]-3-propylurea
CID 122275511
N-[[3-(1-methylpyrazol-4-yl)pyrazin-2-yl]methyl]-4-pyrazol-1-ylbenzenesulfonamide
CID 122246650
N-[[3-(1-methylpyrazol-4-yl)pyrazin-2-yl]methyl]naphthalene-1-sulfonamide
CID 122162763
N-[(2-ethoxyphenyl)methyl]pyridine-3-sulfonamide
CID 25045130

Frequently Asked Questions

What is the IUPAC name of N-[[2-(1-methylpyrazol-4-yl)-3-pyridinyl]methyl]pyridine-3-sulfonamide?
The IUPAC name of N-[[2-(1-methylpyrazol-4-yl)-3-pyridinyl]methyl]pyridine-3-sulfonamide (CID 122275551) is N-[[2-(1-methylpyrazol-4-yl)-3-pyridinyl]methyl]pyridine-3-sulfonamide.
What is the SMILES notation for N-[[2-(1-methylpyrazol-4-yl)-3-pyridinyl]methyl]pyridine-3-sulfonamide?
The canonical SMILES for N-[[2-(1-methylpyrazol-4-yl)-3-pyridinyl]methyl]pyridine-3-sulfonamide is Cn1cc(-c2ncccc2CNS(=O)(=O)c2cccnc2)cn1.
What is the InChIKey of N-[[2-(1-methylpyrazol-4-yl)-3-pyridinyl]methyl]pyridine-3-sulfonamide?
The InChIKey is FMGDPJMKAVSKNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N5O2S/c1-20-11-13(8-18-20)15-12(4-2-7-17-15)9-19-23(21,22)14-5-3-6-16-10-14/h2-8,10-11,19H,9H2,1H3.
What are the key properties of N-[[2-(1-methylpyrazol-4-yl)-3-pyridinyl]methyl]pyridine-3-sulfonamide?
N-[[2-(1-methylpyrazol-4-yl)-3-pyridinyl]methyl]pyridine-3-sulfonamide has a molecular weight of 329.39 g/mol, XLogP of 1.36, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(1-methylpyrazol-4-yl)-3-pyridinyl]methyl]pyridine-3-sulfonamide is sourced from PubChem (CID 122275551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).