N-(2-morpholin-4-yl-5-piperidin-1-ylsulfonylphenyl)-6-pyrazol-1-ylpyridine-3-carboxamide

C24H28N6O4S — CID 25326218

IUPACN-(2-morpholin-4-yl-5-piperidin-1-ylsulfonylphenyl)-6-pyrazol-1-ylpyridine-3-carboxamide
SMILESO=C(Nc1cc(S(=O)(=O)N2CCCCC2)ccc1N1CCOCC1)c1ccc(-n2cccn2)nc1
InChIInChI=1S/C24H28N6O4S/c31-24(19-5-8-23(25-18-19)30-12-4-9-26-30)27-21-17-20(35(32,33)29-10-2-1-3-11-29)6-7-22(21)28-13-15-34-16-14-28/h4-9,12,17-18H,1-3,10-11,13-16H2,(H,27,31)
InChIKeyCABRHKDJQCIJJX-UHFFFAOYSA-N
MW496.59 g/mol
LogP2.53
Rot. Bonds6

About N-(2-morpholin-4-yl-5-piperidin-1-ylsulfonylphenyl)-6-pyrazol-1-ylpyridine-3-carboxamide

N-(2-morpholin-4-yl-5-piperidin-1-ylsulfonylphenyl)-6-pyrazol-1-ylpyridine-3-carboxamide (PubChem CID 25326218) has the molecular formula C24H28N6O4S and a molecular weight of 496.59 g/mol. Its IUPAC name is N-(2-morpholin-4-yl-5-piperidin-1-ylsulfonylphenyl)-6-pyrazol-1-ylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-morpholin-4-yl-5-piperidin-1-ylsulfonylphenyl)-6-pyrazol-1-ylpyridine-3-carboxamide
PubChem CID25326218
Molecular FormulaC24H28N6O4S
Molecular Weight496.59 g/mol
Exact Mass496.19
IUPAC NameN-(2-morpholin-4-yl-5-piperidin-1-ylsulfonylphenyl)-6-pyrazol-1-ylpyridine-3-carboxamide
SMILESO=C(Nc1cc(S(=O)(=O)N2CCCCC2)ccc1N1CCOCC1)c1ccc(-n2cccn2)nc1
InChIInChI=1S/C24H28N6O4S/c31-24(19-5-8-23(25-18-19)30-12-4-9-26-30)27-21-17-20(35(32,33)29-10-2-1-3-11-29)6-7-22(21)28-13-15-34-16-14-28/h4-9,12,17-18H,1-3,10-11,13-16H2,(H,27,31)
InChIKeyCABRHKDJQCIJJX-UHFFFAOYSA-N
XLogP2.53
TPSA109.66 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500496.59
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Related Compounds

N-(5-morpholin-4-ylsulfonyl-2-piperidin-1-ylphenyl)-4-pyrazol-1-ylbenzamide
CID 55369390
N-[2-(azepan-1-yl)-5-morpholin-4-ylsulfonylphenyl]-2-chloropyridine-4-carboxamide
CID 55456739
2-methyl-N-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-ylphenyl)-1,3-dioxoisoindole-5-carboxamide
CID 55329357
3-methoxy-4-methyl-N-(5-morpholin-4-ylsulfonyl-2-piperidin-1-ylphenyl)benzamide
CID 55411892
3,4-dimethoxy-N-(2-morpholin-4-yl-5-morpholin-4-ylsulfonylphenyl)benzamide
CID 4521937
3-(azepan-1-ylsulfonyl)-4-chloro-N-[5-[(2-chlorophenyl)sulfamoyl]-2-morpholin-4-ylphenyl]benzamide
CID 4691182
5-methyl-N-(5-morpholin-4-ylsulfonyl-2-piperidin-1-ylphenyl)-1,2-oxazole-3-carboxamide
CID 4849644
N-(2-morpholin-4-yl-5-piperidin-1-ylsulfonylphenyl)-2-oxo-1H-quinoline-4-carboxamide
CID 4869878
N-(2-morpholin-4-yl-5-piperidin-1-ylsulfonylphenyl)hexanamide
CID 18084204
4-acetamido-N-(2-piperidin-1-yl-5-piperidin-1-ylsulfonylphenyl)benzamide
CID 26524447
[2-[2-morpholin-4-yl-5-(trifluoromethyl)anilino]-2-oxoethyl] 6-pyrazol-1-ylpyridine-3-carboxylate
CID 55522579
3-methyl-N-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-ylphenyl)-1,2-oxazole-5-carboxamide
CID 43031283

Frequently Asked Questions

What is the IUPAC name of N-(2-morpholin-4-yl-5-piperidin-1-ylsulfonylphenyl)-6-pyrazol-1-ylpyridine-3-carboxamide?
The IUPAC name of N-(2-morpholin-4-yl-5-piperidin-1-ylsulfonylphenyl)-6-pyrazol-1-ylpyridine-3-carboxamide (CID 25326218) is N-(2-morpholin-4-yl-5-piperidin-1-ylsulfonylphenyl)-6-pyrazol-1-ylpyridine-3-carboxamide.
What is the SMILES notation for N-(2-morpholin-4-yl-5-piperidin-1-ylsulfonylphenyl)-6-pyrazol-1-ylpyridine-3-carboxamide?
The canonical SMILES for N-(2-morpholin-4-yl-5-piperidin-1-ylsulfonylphenyl)-6-pyrazol-1-ylpyridine-3-carboxamide is O=C(Nc1cc(S(=O)(=O)N2CCCCC2)ccc1N1CCOCC1)c1ccc(-n2cccn2)nc1.
What is the InChIKey of N-(2-morpholin-4-yl-5-piperidin-1-ylsulfonylphenyl)-6-pyrazol-1-ylpyridine-3-carboxamide?
The InChIKey is CABRHKDJQCIJJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N6O4S/c31-24(19-5-8-23(25-18-19)30-12-4-9-26-30)27-21-17-20(35(32,33)29-10-2-1-3-11-29)6-7-22(21)28-13-15-34-16-14-28/h4-9,12,17-18H,1-3,10-11,13-16H2,(H,27,31).
What are the key properties of N-(2-morpholin-4-yl-5-piperidin-1-ylsulfonylphenyl)-6-pyrazol-1-ylpyridine-3-carboxamide?
N-(2-morpholin-4-yl-5-piperidin-1-ylsulfonylphenyl)-6-pyrazol-1-ylpyridine-3-carboxamide has a molecular weight of 496.59 g/mol, XLogP of 2.53, 6 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-morpholin-4-yl-5-piperidin-1-ylsulfonylphenyl)-6-pyrazol-1-ylpyridine-3-carboxamide is sourced from PubChem (CID 25326218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).