6-(propylamino)-N-(1H-pyrazol-4-yl)pyridine-3-sulfonamide

C11H15N5O2S — CID 62147845

IUPAC6-(propylamino)-N-(1H-pyrazol-4-yl)pyridine-3-sulfonamide
SMILESCCCNc1ccc(S(=O)(=O)Nc2cn[nH]c2)cn1
InChIInChI=1S/C11H15N5O2S/c1-2-5-12-11-4-3-10(8-13-11)19(17,18)16-9-6-14-15-7-9/h3-4,6-8,16H,2,5H2,1H3,(H,12,13)(H,14,15)
InChIKeyDRDLQBXIXRWJRJ-UHFFFAOYSA-N
MW281.34 g/mol
LogP1.43
Rot. Bonds6

About 6-(propylamino)-N-(1H-pyrazol-4-yl)pyridine-3-sulfonamide

6-(propylamino)-N-(1H-pyrazol-4-yl)pyridine-3-sulfonamide (PubChem CID 62147845) has the molecular formula C11H15N5O2S and a molecular weight of 281.34 g/mol. Its IUPAC name is 6-(propylamino)-N-(1H-pyrazol-4-yl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name6-(propylamino)-N-(1H-pyrazol-4-yl)pyridine-3-sulfonamide
PubChem CID62147845
Molecular FormulaC11H15N5O2S
Molecular Weight281.34 g/mol
Exact Mass281.09
IUPAC Name6-(propylamino)-N-(1H-pyrazol-4-yl)pyridine-3-sulfonamide
SMILESCCCNc1ccc(S(=O)(=O)Nc2cn[nH]c2)cn1
InChIInChI=1S/C11H15N5O2S/c1-2-5-12-11-4-3-10(8-13-11)19(17,18)16-9-6-14-15-7-9/h3-4,6-8,16H,2,5H2,1H3,(H,12,13)(H,14,15)
InChIKeyDRDLQBXIXRWJRJ-UHFFFAOYSA-N
XLogP1.43
TPSA99.77 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.34
LogP ≤ 51.43
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(propylamino)-N-(1H-pyrazol-4-yl)pyridine-3-sulfonamide?
The IUPAC name of 6-(propylamino)-N-(1H-pyrazol-4-yl)pyridine-3-sulfonamide (CID 62147845) is 6-(propylamino)-N-(1H-pyrazol-4-yl)pyridine-3-sulfonamide.
What is the SMILES notation for 6-(propylamino)-N-(1H-pyrazol-4-yl)pyridine-3-sulfonamide?
The canonical SMILES for 6-(propylamino)-N-(1H-pyrazol-4-yl)pyridine-3-sulfonamide is CCCNc1ccc(S(=O)(=O)Nc2cn[nH]c2)cn1.
What is the InChIKey of 6-(propylamino)-N-(1H-pyrazol-4-yl)pyridine-3-sulfonamide?
The InChIKey is DRDLQBXIXRWJRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5O2S/c1-2-5-12-11-4-3-10(8-13-11)19(17,18)16-9-6-14-15-7-9/h3-4,6-8,16H,2,5H2,1H3,(H,12,13)(H,14,15).
What are the key properties of 6-(propylamino)-N-(1H-pyrazol-4-yl)pyridine-3-sulfonamide?
6-(propylamino)-N-(1H-pyrazol-4-yl)pyridine-3-sulfonamide has a molecular weight of 281.34 g/mol, XLogP of 1.43, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(propylamino)-N-(1H-pyrazol-4-yl)pyridine-3-sulfonamide is sourced from PubChem (CID 62147845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).