N-[4-[1-(pyridin-3-ylmethyl)piperidine-4-carbonyl]phenyl]methanesulfonamide

C19H23N3O3S — CID 14130060

IUPACN-[4-[1-(pyridin-3-ylmethyl)piperidine-4-carbonyl]phenyl]methanesulfonamide
SMILESCS(=O)(=O)Nc1ccc(C(=O)C2CCN(Cc3cccnc3)CC2)cc1
InChIInChI=1S/C19H23N3O3S/c1-26(24,25)21-18-6-4-16(5-7-18)19(23)17-8-11-22(12-9-17)14-15-3-2-10-20-13-15/h2-7,10,13,17,21H,8-9,11-12,14H2,1H3
InChIKeyGNDGFSAUIMIJMG-UHFFFAOYSA-N
MW373.48 g/mol
LogP2.55
Rot. Bonds6

About N-[4-[1-(pyridin-3-ylmethyl)piperidine-4-carbonyl]phenyl]methanesulfonamide

N-[4-[1-(pyridin-3-ylmethyl)piperidine-4-carbonyl]phenyl]methanesulfonamide (PubChem CID 14130060) has the molecular formula C19H23N3O3S and a molecular weight of 373.48 g/mol. Its IUPAC name is N-[4-[1-(pyridin-3-ylmethyl)piperidine-4-carbonyl]phenyl]methanesulfonamide.

Molecular Properties

Compound NameN-[4-[1-(pyridin-3-ylmethyl)piperidine-4-carbonyl]phenyl]methanesulfonamide
PubChem CID14130060
Molecular FormulaC19H23N3O3S
Molecular Weight373.48 g/mol
Exact Mass373.15
IUPAC NameN-[4-[1-(pyridin-3-ylmethyl)piperidine-4-carbonyl]phenyl]methanesulfonamide
SMILESCS(=O)(=O)Nc1ccc(C(=O)C2CCN(Cc3cccnc3)CC2)cc1
InChIInChI=1S/C19H23N3O3S/c1-26(24,25)21-18-6-4-16(5-7-18)19(23)17-8-11-22(12-9-17)14-15-3-2-10-20-13-15/h2-7,10,13,17,21H,8-9,11-12,14H2,1H3
InChIKeyGNDGFSAUIMIJMG-UHFFFAOYSA-N
XLogP2.55
TPSA79.37 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.48
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[4-[1-(pyridin-3-ylmethyl)piperidine-4-carbonyl]phenyl]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-[1-(3-oxo-2-pyridin-3-ylpropyl)piperidine-4-carbonyl]phenyl]methanesulfonamide
CID 174247981
methyl (3S)-1-(pyridin-3-ylmethyl)pyrrolidine-3-carboxylate
CID 142605380
N-[4-(cyclobutanecarbonyl)phenyl]methanesulfonamide
CID 43161158
(4-methylpiperidin-1-yl)-[1-(pyridin-3-ylmethyl)piperidin-4-yl]methanone;oxalic acid
CID 126468803
N-[4-[4-[[4-(4-benzylpiperazine-1-carbonyl)piperidin-1-yl]methyl]phenoxy]phenyl]methanesulfonamide
CID 67037740
(4,4-difluoropiperidin-1-yl)-[1-(pyridin-3-ylmethyl)piperidin-4-yl]methanone
CID 155975853
(4-phenylphenyl)-[1-(pyridin-3-ylmethyl)piperidin-3-yl]methanone
CID 45178461
N-[4-(oxane-4-carbonyl)phenyl]methanesulfonamide
CID 62907557
1-benzyl-N-(pyridin-3-ylmethyl)piperidine-4-carboxamide
CID 3404052
N-(1-methoxypropan-2-yl)-1-(pyridin-3-ylmethyl)piperidine-4-carboxamide
CID 4614545
4-[(4-methylsulfonylpiperazin-1-yl)methyl]-N-(pyridin-3-ylmethyl)benzamide
CID 43921877
1-butyl-1-[1-[[4-[4-(methanesulfonamido)phenoxy]phenyl]methyl]piperidin-4-yl]-3-pyridin-3-ylurea;dihydrochloride
CID 67038138

Frequently Asked Questions

What is the IUPAC name of N-[4-[1-(pyridin-3-ylmethyl)piperidine-4-carbonyl]phenyl]methanesulfonamide?
The IUPAC name of N-[4-[1-(pyridin-3-ylmethyl)piperidine-4-carbonyl]phenyl]methanesulfonamide (CID 14130060) is N-[4-[1-(pyridin-3-ylmethyl)piperidine-4-carbonyl]phenyl]methanesulfonamide.
What is the SMILES notation for N-[4-[1-(pyridin-3-ylmethyl)piperidine-4-carbonyl]phenyl]methanesulfonamide?
The canonical SMILES for N-[4-[1-(pyridin-3-ylmethyl)piperidine-4-carbonyl]phenyl]methanesulfonamide is CS(=O)(=O)Nc1ccc(C(=O)C2CCN(Cc3cccnc3)CC2)cc1.
What is the InChIKey of N-[4-[1-(pyridin-3-ylmethyl)piperidine-4-carbonyl]phenyl]methanesulfonamide?
The InChIKey is GNDGFSAUIMIJMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O3S/c1-26(24,25)21-18-6-4-16(5-7-18)19(23)17-8-11-22(12-9-17)14-15-3-2-10-20-13-15/h2-7,10,13,17,21H,8-9,11-12,14H2,1H3.
What are the key properties of N-[4-[1-(pyridin-3-ylmethyl)piperidine-4-carbonyl]phenyl]methanesulfonamide?
N-[4-[1-(pyridin-3-ylmethyl)piperidine-4-carbonyl]phenyl]methanesulfonamide has a molecular weight of 373.48 g/mol, XLogP of 2.55, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[1-(pyridin-3-ylmethyl)piperidine-4-carbonyl]phenyl]methanesulfonamide is sourced from PubChem (CID 14130060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).