1-(3-chloro-4-fluorophenyl)sulfonyl-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidine-4-carboxamide

C23H26ClFN2O3S — CID 46555058

IUPAC1-(3-chloro-4-fluorophenyl)sulfonyl-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidine-4-carboxamide
SMILESCN(C(=O)C1CCN(S(=O)(=O)c2ccc(F)c(Cl)c2)CC1)C1CCCc2ccccc21
InChIInChI=1S/C23H26ClFN2O3S/c1-26(22-8-4-6-16-5-2-3-7-19(16)22)23(28)17-11-13-27(14-12-17)31(29,30)18-9-10-21(25)20(24)15-18/h2-3,5,7,9-10,15,17,22H,4,6,8,11-14H2,1H3
InChIKeyIGLYOOIDPOWUHD-UHFFFAOYSA-N
MW464.99 g/mol
LogP4.42
Rot. Bonds4

About 1-(3-chloro-4-fluorophenyl)sulfonyl-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidine-4-carboxamide

1-(3-chloro-4-fluorophenyl)sulfonyl-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidine-4-carboxamide (PubChem CID 46555058) has the molecular formula C23H26ClFN2O3S and a molecular weight of 464.99 g/mol. Its IUPAC name is 1-(3-chloro-4-fluorophenyl)sulfonyl-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(3-chloro-4-fluorophenyl)sulfonyl-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidine-4-carboxamide
PubChem CID46555058
Molecular FormulaC23H26ClFN2O3S
Molecular Weight464.99 g/mol
Exact Mass464.13
IUPAC Name1-(3-chloro-4-fluorophenyl)sulfonyl-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidine-4-carboxamide
SMILESCN(C(=O)C1CCN(S(=O)(=O)c2ccc(F)c(Cl)c2)CC1)C1CCCc2ccccc21
InChIInChI=1S/C23H26ClFN2O3S/c1-26(22-8-4-6-16-5-2-3-7-19(16)22)23(28)17-11-13-27(14-12-17)31(29,30)18-9-10-21(25)20(24)15-18/h2-3,5,7,9-10,15,17,22H,4,6,8,11-14H2,1H3
InChIKeyIGLYOOIDPOWUHD-UHFFFAOYSA-N
XLogP4.42
TPSA57.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500464.99
LogP ≤ 54.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1-(3-chloro-4-fluorophenyl)sulfonyl-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidine-4-carboxamide 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

1-(3-chloro-4-fluorophenyl)sulfonyl-N-methyl-N-(1-methylpiperidin-4-yl)piperidine-4-carboxamide
CID 112770532
1-(4-chlorophenyl)sulfonyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidine-4-carboxamide
CID 3761947
1-(3-chloro-4-fluorophenyl)sulfonyl-N,N-bis(cyanomethyl)piperidine-4-carboxamide
CID 60612819
1-(4-chlorophenyl)sulfonyl-N-cyclohexyl-N-methylpiperidine-4-carboxamide
CID 27670607
2-[4-(2-chlorophenyl)sulfonylpiperazin-1-yl]-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide
CID 46809760
1-(3-chloro-4-fluorophenyl)sulfonylpyrrolidine
CID 697773
N-(2,3-dihydro-1H-inden-1-yl)-1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-N-methylpiperidine-4-carboxamide
CID 42941589
1-(3-chloro-4-fluorophenyl)sulfonyl-4-methylpiperidine
CID 697831
1-(4-chlorophenyl)sulfonyl-N-methoxy-N-methylpiperidine-4-carboxamide
CID 27740023
1-(3-chloro-4-fluorophenyl)sulfonyl-N-(2-pyrrolidin-1-ylphenyl)piperidine-4-carboxamide
CID 39752606
[2-oxo-2-(1,2,3,4-tetrahydronaphthalen-1-ylamino)ethyl] 1-(3,4-difluorophenyl)sulfonylpiperidine-4-carboxylate
CID 46793360
1-(3-chloro-4-fluorophenyl)sulfonyl-N,N-diethylpiperidine-3-carboxamide
CID 3846784

Frequently Asked Questions

What is the IUPAC name of 1-(3-chloro-4-fluorophenyl)sulfonyl-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidine-4-carboxamide?
The IUPAC name of 1-(3-chloro-4-fluorophenyl)sulfonyl-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidine-4-carboxamide (CID 46555058) is 1-(3-chloro-4-fluorophenyl)sulfonyl-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(3-chloro-4-fluorophenyl)sulfonyl-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidine-4-carboxamide?
The canonical SMILES for 1-(3-chloro-4-fluorophenyl)sulfonyl-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidine-4-carboxamide is CN(C(=O)C1CCN(S(=O)(=O)c2ccc(F)c(Cl)c2)CC1)C1CCCc2ccccc21.
What is the InChIKey of 1-(3-chloro-4-fluorophenyl)sulfonyl-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidine-4-carboxamide?
The InChIKey is IGLYOOIDPOWUHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26ClFN2O3S/c1-26(22-8-4-6-16-5-2-3-7-19(16)22)23(28)17-11-13-27(14-12-17)31(29,30)18-9-10-21(25)20(24)15-18/h2-3,5,7,9-10,15,17,22H,4,6,8,11-14H2,1H3.
What are the key properties of 1-(3-chloro-4-fluorophenyl)sulfonyl-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidine-4-carboxamide?
1-(3-chloro-4-fluorophenyl)sulfonyl-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidine-4-carboxamide has a molecular weight of 464.99 g/mol, XLogP of 4.42, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-chloro-4-fluorophenyl)sulfonyl-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidine-4-carboxamide is sourced from PubChem (CID 46555058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).