2-[4-[(2-chloro-3-pyridinyl)sulfonylamino]pyrazol-1-yl]acetamide

C10H10ClN5O3S — CID 61051057

IUPAC2-[4-[(2-chloro-3-pyridinyl)sulfonylamino]pyrazol-1-yl]acetamide
SMILESNC(=O)Cn1cc(NS(=O)(=O)c2cccnc2Cl)cn1
InChIInChI=1S/C10H10ClN5O3S/c11-10-8(2-1-3-13-10)20(18,19)15-7-4-14-16(5-7)6-9(12)17/h1-5,15H,6H2,(H2,12,17)
InChIKeyUOGJOHBERAVLIV-UHFFFAOYSA-N
MW315.74 g/mol
LogP0.22
Rot. Bonds5

About 2-[4-[(2-chloro-3-pyridinyl)sulfonylamino]pyrazol-1-yl]acetamide

2-[4-[(2-chloro-3-pyridinyl)sulfonylamino]pyrazol-1-yl]acetamide (PubChem CID 61051057) has the molecular formula C10H10ClN5O3S and a molecular weight of 315.74 g/mol. Its IUPAC name is 2-[4-[(2-chloro-3-pyridinyl)sulfonylamino]pyrazol-1-yl]acetamide.

Molecular Properties

Compound Name2-[4-[(2-chloro-3-pyridinyl)sulfonylamino]pyrazol-1-yl]acetamide
PubChem CID61051057
Molecular FormulaC10H10ClN5O3S
Molecular Weight315.74 g/mol
Exact Mass315.02
IUPAC Name2-[4-[(2-chloro-3-pyridinyl)sulfonylamino]pyrazol-1-yl]acetamide
SMILESNC(=O)Cn1cc(NS(=O)(=O)c2cccnc2Cl)cn1
InChIInChI=1S/C10H10ClN5O3S/c11-10-8(2-1-3-13-10)20(18,19)15-7-4-14-16(5-7)6-9(12)17/h1-5,15H,6H2,(H2,12,17)
InChIKeyUOGJOHBERAVLIV-UHFFFAOYSA-N
XLogP0.22
TPSA119.97 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.74
LogP ≤ 50.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-[4-[(2-chloro-3-pyridinyl)sulfonylamino]pyrazol-1-yl]acetamide?
The IUPAC name of 2-[4-[(2-chloro-3-pyridinyl)sulfonylamino]pyrazol-1-yl]acetamide (CID 61051057) is 2-[4-[(2-chloro-3-pyridinyl)sulfonylamino]pyrazol-1-yl]acetamide.
What is the SMILES notation for 2-[4-[(2-chloro-3-pyridinyl)sulfonylamino]pyrazol-1-yl]acetamide?
The canonical SMILES for 2-[4-[(2-chloro-3-pyridinyl)sulfonylamino]pyrazol-1-yl]acetamide is NC(=O)Cn1cc(NS(=O)(=O)c2cccnc2Cl)cn1.
What is the InChIKey of 2-[4-[(2-chloro-3-pyridinyl)sulfonylamino]pyrazol-1-yl]acetamide?
The InChIKey is UOGJOHBERAVLIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10ClN5O3S/c11-10-8(2-1-3-13-10)20(18,19)15-7-4-14-16(5-7)6-9(12)17/h1-5,15H,6H2,(H2,12,17).
What are the key properties of 2-[4-[(2-chloro-3-pyridinyl)sulfonylamino]pyrazol-1-yl]acetamide?
2-[4-[(2-chloro-3-pyridinyl)sulfonylamino]pyrazol-1-yl]acetamide has a molecular weight of 315.74 g/mol, XLogP of 0.22, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(2-chloro-3-pyridinyl)sulfonylamino]pyrazol-1-yl]acetamide is sourced from PubChem (CID 61051057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).