1-(dimethylsulfamoyl)-N-[3-(1H-pyrazol-5-yl)phenyl]piperidine-4-carboxamide

C17H23N5O3S — CID 72888802

IUPAC1-(dimethylsulfamoyl)-N-[3-(1H-pyrazol-5-yl)phenyl]piperidine-4-carboxamide
SMILESCN(C)S(=O)(=O)N1CCC(C(=O)Nc2cccc(-c3ccn[nH]3)c2)CC1
InChIInChI=1S/C17H23N5O3S/c1-21(2)26(24,25)22-10-7-13(8-11-22)17(23)19-15-5-3-4-14(12-15)16-6-9-18-20-16/h3-6,9,12-13H,7-8,10-11H2,1-2H3,(H,18,20)(H,19,23)
InChIKeyFHNZDMDDPMZOIE-UHFFFAOYSA-N
MW377.47 g/mol
LogP1.53
Rot. Bonds5

About 1-(dimethylsulfamoyl)-N-[3-(1H-pyrazol-5-yl)phenyl]piperidine-4-carboxamide

1-(dimethylsulfamoyl)-N-[3-(1H-pyrazol-5-yl)phenyl]piperidine-4-carboxamide (PubChem CID 72888802) has the molecular formula C17H23N5O3S and a molecular weight of 377.47 g/mol. Its IUPAC name is 1-(dimethylsulfamoyl)-N-[3-(1H-pyrazol-5-yl)phenyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(dimethylsulfamoyl)-N-[3-(1H-pyrazol-5-yl)phenyl]piperidine-4-carboxamide
PubChem CID72888802
Molecular FormulaC17H23N5O3S
Molecular Weight377.47 g/mol
Exact Mass377.15
IUPAC Name1-(dimethylsulfamoyl)-N-[3-(1H-pyrazol-5-yl)phenyl]piperidine-4-carboxamide
SMILESCN(C)S(=O)(=O)N1CCC(C(=O)Nc2cccc(-c3ccn[nH]3)c2)CC1
InChIInChI=1S/C17H23N5O3S/c1-21(2)26(24,25)22-10-7-13(8-11-22)17(23)19-15-5-3-4-14(12-15)16-6-9-18-20-16/h3-6,9,12-13H,7-8,10-11H2,1-2H3,(H,18,20)(H,19,23)
InChIKeyFHNZDMDDPMZOIE-UHFFFAOYSA-N
XLogP1.53
TPSA98.40 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.47
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-(1H-pyrazol-5-yl)phenyl]-1-pyridin-3-ylsulfonylpiperidine-4-carboxamide
CID 46412516
1-(dimethylsulfamoyl)-N-[3-(trifluoromethyl)phenyl]piperidine-4-carboxamide
CID 19062300
N-[3-(1H-pyrazol-5-yl)phenyl]pyrrolidine-3-carboxamide;hydrochloride
CID 119707800
N-[3-(1H-pyrazol-5-yl)phenyl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine-7-carboxamide
CID 138013343
1-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-[3-(1H-pyrazol-5-yl)phenyl]piperidine-4-carboxamide
CID 42519475
1-[[3-(1H-pyrazol-5-yl)phenyl]carbamoyl]piperidine-4-carboxylic acid
CID 122090082
1-[(1-methylbenzimidazol-2-yl)methyl]-N-[3-(1H-pyrazol-5-yl)phenyl]piperidine-4-carboxamide
CID 29211136
1-(2,1,3-benzoxadiazol-5-ylmethyl)-N-[3-(1H-pyrazol-5-yl)phenyl]piperidine-4-carboxamide
CID 126460633
1-(dimethylsulfamoyl)-N-(2-phenylphenyl)piperidine-4-carboxamide
CID 41455218
N-[3-(1H-pyrazol-5-yl)phenyl]azepane-1-carboxamide
CID 79157648
2-methyl-N-[3-(1H-pyrazol-5-yl)phenyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-6-carboxamide
CID 154869493
1-(dimethylsulfamoyl)-N-(4-ethylphenyl)piperidine-4-carboxamide
CID 41454669

Frequently Asked Questions

What is the IUPAC name of 1-(dimethylsulfamoyl)-N-[3-(1H-pyrazol-5-yl)phenyl]piperidine-4-carboxamide?
The IUPAC name of 1-(dimethylsulfamoyl)-N-[3-(1H-pyrazol-5-yl)phenyl]piperidine-4-carboxamide (CID 72888802) is 1-(dimethylsulfamoyl)-N-[3-(1H-pyrazol-5-yl)phenyl]piperidine-4-carboxamide.
What is the SMILES notation for 1-(dimethylsulfamoyl)-N-[3-(1H-pyrazol-5-yl)phenyl]piperidine-4-carboxamide?
The canonical SMILES for 1-(dimethylsulfamoyl)-N-[3-(1H-pyrazol-5-yl)phenyl]piperidine-4-carboxamide is CN(C)S(=O)(=O)N1CCC(C(=O)Nc2cccc(-c3ccn[nH]3)c2)CC1.
What is the InChIKey of 1-(dimethylsulfamoyl)-N-[3-(1H-pyrazol-5-yl)phenyl]piperidine-4-carboxamide?
The InChIKey is FHNZDMDDPMZOIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N5O3S/c1-21(2)26(24,25)22-10-7-13(8-11-22)17(23)19-15-5-3-4-14(12-15)16-6-9-18-20-16/h3-6,9,12-13H,7-8,10-11H2,1-2H3,(H,18,20)(H,19,23).
What are the key properties of 1-(dimethylsulfamoyl)-N-[3-(1H-pyrazol-5-yl)phenyl]piperidine-4-carboxamide?
1-(dimethylsulfamoyl)-N-[3-(1H-pyrazol-5-yl)phenyl]piperidine-4-carboxamide has a molecular weight of 377.47 g/mol, XLogP of 1.53, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(dimethylsulfamoyl)-N-[3-(1H-pyrazol-5-yl)phenyl]piperidine-4-carboxamide is sourced from PubChem (CID 72888802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).