2-[(4-chloro-1H-indazol-5-yl)sulfamoyl]-N,N-dimethylpyridine-3-carboxamide

C15H14ClN5O3S — CID 166365288

IUPAC2-[(4-chloro-1H-indazol-5-yl)sulfamoyl]-N,N-dimethylpyridine-3-carboxamide
SMILESCN(C)C(=O)c1cccnc1S(=O)(=O)Nc1ccc2[nH]ncc2c1Cl
InChIInChI=1S/C15H14ClN5O3S/c1-21(2)15(22)9-4-3-7-17-14(9)25(23,24)20-12-6-5-11-10(13(12)16)8-18-19-11/h3-8,20H,1-2H3,(H,18,19)
InChIKeyZMJKQBQXONSMPR-UHFFFAOYSA-N
MW379.83 g/mol
LogP2.11
Rot. Bonds4

About 2-[(4-chloro-1H-indazol-5-yl)sulfamoyl]-N,N-dimethylpyridine-3-carboxamide

2-[(4-chloro-1H-indazol-5-yl)sulfamoyl]-N,N-dimethylpyridine-3-carboxamide (PubChem CID 166365288) has the molecular formula C15H14ClN5O3S and a molecular weight of 379.83 g/mol. Its IUPAC name is 2-[(4-chloro-1H-indazol-5-yl)sulfamoyl]-N,N-dimethylpyridine-3-carboxamide.

Molecular Properties

Compound Name2-[(4-chloro-1H-indazol-5-yl)sulfamoyl]-N,N-dimethylpyridine-3-carboxamide
PubChem CID166365288
Molecular FormulaC15H14ClN5O3S
Molecular Weight379.83 g/mol
Exact Mass379.05
IUPAC Name2-[(4-chloro-1H-indazol-5-yl)sulfamoyl]-N,N-dimethylpyridine-3-carboxamide
SMILESCN(C)C(=O)c1cccnc1S(=O)(=O)Nc1ccc2[nH]ncc2c1Cl
InChIInChI=1S/C15H14ClN5O3S/c1-21(2)15(22)9-4-3-7-17-14(9)25(23,24)20-12-6-5-11-10(13(12)16)8-18-19-11/h3-8,20H,1-2H3,(H,18,19)
InChIKeyZMJKQBQXONSMPR-UHFFFAOYSA-N
XLogP2.11
TPSA108.05 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.83
LogP ≤ 52.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[(4-chloro-1H-indazol-5-yl)sulfamoyl]-N,N-dimethylpyridine-3-carboxamide?
The IUPAC name of 2-[(4-chloro-1H-indazol-5-yl)sulfamoyl]-N,N-dimethylpyridine-3-carboxamide (CID 166365288) is 2-[(4-chloro-1H-indazol-5-yl)sulfamoyl]-N,N-dimethylpyridine-3-carboxamide.
What is the SMILES notation for 2-[(4-chloro-1H-indazol-5-yl)sulfamoyl]-N,N-dimethylpyridine-3-carboxamide?
The canonical SMILES for 2-[(4-chloro-1H-indazol-5-yl)sulfamoyl]-N,N-dimethylpyridine-3-carboxamide is CN(C)C(=O)c1cccnc1S(=O)(=O)Nc1ccc2[nH]ncc2c1Cl.
What is the InChIKey of 2-[(4-chloro-1H-indazol-5-yl)sulfamoyl]-N,N-dimethylpyridine-3-carboxamide?
The InChIKey is ZMJKQBQXONSMPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClN5O3S/c1-21(2)15(22)9-4-3-7-17-14(9)25(23,24)20-12-6-5-11-10(13(12)16)8-18-19-11/h3-8,20H,1-2H3,(H,18,19).
What are the key properties of 2-[(4-chloro-1H-indazol-5-yl)sulfamoyl]-N,N-dimethylpyridine-3-carboxamide?
2-[(4-chloro-1H-indazol-5-yl)sulfamoyl]-N,N-dimethylpyridine-3-carboxamide has a molecular weight of 379.83 g/mol, XLogP of 2.11, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-chloro-1H-indazol-5-yl)sulfamoyl]-N,N-dimethylpyridine-3-carboxamide is sourced from PubChem (CID 166365288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).