N-[5-[(3R)-1-[2-(4-fluorophenyl)-2-methylpropanoyl]piperidin-3-yl]-1H-pyrazol-4-yl]methanesulfonamide

C19H25FN4O3S — CID 97343192

IUPACN-[5-[(3R)-1-[2-(4-fluorophenyl)-2-methylpropanoyl]piperidin-3-yl]-1H-pyrazol-4-yl]methanesulfonamide
SMILESCC(C)(C(=O)N1CCC[C@@H](c2[nH]ncc2NS(C)(=O)=O)C1)c1ccc(F)cc1
InChIInChI=1S/C19H25FN4O3S/c1-19(2,14-6-8-15(20)9-7-14)18(25)24-10-4-5-13(12-24)17-16(11-21-22-17)23-28(3,26)27/h6-9,11,13,23H,4-5,10,12H2,1-3H3,(H,21,22)/t13-/m1/s1
InChIKeyVQZXDKNORFNKDU-CYBMUJFWSA-N
MW408.50 g/mol
LogP2.60
Rot. Bonds5

About N-[5-[(3R)-1-[2-(4-fluorophenyl)-2-methylpropanoyl]piperidin-3-yl]-1H-pyrazol-4-yl]methanesulfonamide

N-[5-[(3R)-1-[2-(4-fluorophenyl)-2-methylpropanoyl]piperidin-3-yl]-1H-pyrazol-4-yl]methanesulfonamide (PubChem CID 97343192) has the molecular formula C19H25FN4O3S and a molecular weight of 408.50 g/mol. Its IUPAC name is N-[5-[(3R)-1-[2-(4-fluorophenyl)-2-methylpropanoyl]piperidin-3-yl]-1H-pyrazol-4-yl]methanesulfonamide.

Molecular Properties

Compound NameN-[5-[(3R)-1-[2-(4-fluorophenyl)-2-methylpropanoyl]piperidin-3-yl]-1H-pyrazol-4-yl]methanesulfonamide
PubChem CID97343192
Molecular FormulaC19H25FN4O3S
Molecular Weight408.50 g/mol
Exact Mass408.16
IUPAC NameN-[5-[(3R)-1-[2-(4-fluorophenyl)-2-methylpropanoyl]piperidin-3-yl]-1H-pyrazol-4-yl]methanesulfonamide
SMILESCC(C)(C(=O)N1CCC[C@@H](c2[nH]ncc2NS(C)(=O)=O)C1)c1ccc(F)cc1
InChIInChI=1S/C19H25FN4O3S/c1-19(2,14-6-8-15(20)9-7-14)18(25)24-10-4-5-13(12-24)17-16(11-21-22-17)23-28(3,26)27/h6-9,11,13,23H,4-5,10,12H2,1-3H3,(H,21,22)/t13-/m1/s1
InChIKeyVQZXDKNORFNKDU-CYBMUJFWSA-N
XLogP2.60
TPSA95.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.50
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[5-[(3R)-1-[2-(4-fluorophenyl)-2-methylpropanoyl]piperidin-3-yl]-1H-pyrazol-4-yl]methanesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(4-fluorophenyl)-3-(4-methylsulfonyl-1H-pyrazol-5-yl)piperidine-1-carboxamide
CID 110214013
2-(4-fluorophenyl)-2-methyl-1-[3-(piperidine-1-carbonyl)pyrrolidin-1-yl]propan-1-one
CID 110246474
2-(4-fluorophenyl)-2-methyl-1-[(3R)-3-(piperidine-1-carbonyl)pyrrolidin-1-yl]propan-1-one
CID 92633437
N-[5-[(3S)-1-[3-(3,5-dimethylphenyl)propanoyl]piperidin-3-yl]-1H-pyrazol-4-yl]methanesulfonamide
CID 97343187
N-cyclopentyl-6-[(3S)-1-[2-(4-fluorophenyl)-2-methylpropanoyl]piperidin-3-yl]pyridine-3-carboxamide
CID 92636902
N-[5-[(3R)-1-(4-fluorobenzoyl)piperidin-3-yl]-1H-pyrazol-4-yl]benzamide
CID 97343239
N-[5-[1-(4-fluorobenzoyl)piperidin-3-yl]-1H-pyrazol-4-yl]benzamide
CID 75473815
N-[5-[(3S)-1-(3-fluorobenzoyl)piperidin-3-yl]-1H-pyrazol-4-yl]benzamide
CID 97343244
N-[(4S)-1-[2-(4-fluorophenyl)-2-methylpropanoyl]azepan-4-yl]-5-methylpyrazine-2-carboxamide
CID 92634952
2-hydroxy-2-methyl-1-[3-[4-(4-methylphenyl)-1H-pyrazol-5-yl]piperidin-1-yl]propan-1-one
CID 56746262
2-amino-2-methyl-1-[3-(4-phenyl-1H-pyrazol-5-yl)piperidin-1-yl]propan-1-one
CID 56744023
2-amino-2-methyl-1-[(3S)-3-[4-(4-methylphenyl)-1H-pyrazol-5-yl]piperidin-1-yl]propan-1-one
CID 95196951

Frequently Asked Questions

What is the IUPAC name of N-[5-[(3R)-1-[2-(4-fluorophenyl)-2-methylpropanoyl]piperidin-3-yl]-1H-pyrazol-4-yl]methanesulfonamide?
The IUPAC name of N-[5-[(3R)-1-[2-(4-fluorophenyl)-2-methylpropanoyl]piperidin-3-yl]-1H-pyrazol-4-yl]methanesulfonamide (CID 97343192) is N-[5-[(3R)-1-[2-(4-fluorophenyl)-2-methylpropanoyl]piperidin-3-yl]-1H-pyrazol-4-yl]methanesulfonamide.
What is the SMILES notation for N-[5-[(3R)-1-[2-(4-fluorophenyl)-2-methylpropanoyl]piperidin-3-yl]-1H-pyrazol-4-yl]methanesulfonamide?
The canonical SMILES for N-[5-[(3R)-1-[2-(4-fluorophenyl)-2-methylpropanoyl]piperidin-3-yl]-1H-pyrazol-4-yl]methanesulfonamide is CC(C)(C(=O)N1CCC[C@@H](c2[nH]ncc2NS(C)(=O)=O)C1)c1ccc(F)cc1.
What is the InChIKey of N-[5-[(3R)-1-[2-(4-fluorophenyl)-2-methylpropanoyl]piperidin-3-yl]-1H-pyrazol-4-yl]methanesulfonamide?
The InChIKey is VQZXDKNORFNKDU-CYBMUJFWSA-N. The full InChI is InChI=1S/C19H25FN4O3S/c1-19(2,14-6-8-15(20)9-7-14)18(25)24-10-4-5-13(12-24)17-16(11-21-22-17)23-28(3,26)27/h6-9,11,13,23H,4-5,10,12H2,1-3H3,(H,21,22)/t13-/m1/s1.
What are the key properties of N-[5-[(3R)-1-[2-(4-fluorophenyl)-2-methylpropanoyl]piperidin-3-yl]-1H-pyrazol-4-yl]methanesulfonamide?
N-[5-[(3R)-1-[2-(4-fluorophenyl)-2-methylpropanoyl]piperidin-3-yl]-1H-pyrazol-4-yl]methanesulfonamide has a molecular weight of 408.50 g/mol, XLogP of 2.60, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[(3R)-1-[2-(4-fluorophenyl)-2-methylpropanoyl]piperidin-3-yl]-1H-pyrazol-4-yl]methanesulfonamide is sourced from PubChem (CID 97343192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).