N-(2-chlorophenyl)-1-naphthalen-2-ylsulfonylpiperidine-4-carboxamide

C22H21ClN2O3S — CID 26574910

IUPACN-(2-chlorophenyl)-1-naphthalen-2-ylsulfonylpiperidine-4-carboxamide
SMILESO=C(Nc1ccccc1Cl)C1CCN(S(=O)(=O)c2ccc3ccccc3c2)CC1
InChIInChI=1S/C22H21ClN2O3S/c23-20-7-3-4-8-21(20)24-22(26)17-11-13-25(14-12-17)29(27,28)19-10-9-16-5-1-2-6-18(16)15-19/h1-10,15,17H,11-14H2,(H,24,26)
InChIKeyVEYYSDMVIGGWSU-UHFFFAOYSA-N
MW428.94 g/mol
LogP4.53
Rot. Bonds4

About N-(2-chlorophenyl)-1-naphthalen-2-ylsulfonylpiperidine-4-carboxamide

N-(2-chlorophenyl)-1-naphthalen-2-ylsulfonylpiperidine-4-carboxamide (PubChem CID 26574910) has the molecular formula C22H21ClN2O3S and a molecular weight of 428.94 g/mol. Its IUPAC name is N-(2-chlorophenyl)-1-naphthalen-2-ylsulfonylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)-1-naphthalen-2-ylsulfonylpiperidine-4-carboxamide
PubChem CID26574910
Molecular FormulaC22H21ClN2O3S
Molecular Weight428.94 g/mol
Exact Mass428.10
IUPAC NameN-(2-chlorophenyl)-1-naphthalen-2-ylsulfonylpiperidine-4-carboxamide
SMILESO=C(Nc1ccccc1Cl)C1CCN(S(=O)(=O)c2ccc3ccccc3c2)CC1
InChIInChI=1S/C22H21ClN2O3S/c23-20-7-3-4-8-21(20)24-22(26)17-11-13-25(14-12-17)29(27,28)19-10-9-16-5-1-2-6-18(16)15-19/h1-10,15,17H,11-14H2,(H,24,26)
InChIKeyVEYYSDMVIGGWSU-UHFFFAOYSA-N
XLogP4.53
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500428.94
LogP ≤ 54.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-ethylphenyl)-1-naphthalen-2-ylsulfonylpiperidine-4-carboxamide
CID 26208569
N-(2-chlorophenyl)-1-(4-methoxyphenyl)sulfonylpiperidine-4-carboxamide
CID 1075573
N-(2-chlorophenyl)-1-(3-methylsulfonylphenyl)sulfonylpiperidine-4-carboxamide
CID 16935229
N-(4-acetamidophenyl)-1-naphthalen-2-ylsulfonylpiperidine-4-carboxamide
CID 26499572
N-(3-chloro-4-fluorophenyl)-1-naphthalen-2-ylsulfonylpiperidine-4-carboxamide
CID 26695983
N-(2-bromo-4-methylphenyl)-1-naphthalen-2-ylsulfonylpiperidine-4-carboxamide
CID 26774997
N-(2-chlorophenyl)-1-(4-methoxy-3-methylphenyl)sulfonylpiperidine-4-carboxamide
CID 1092875
1-naphthalen-2-ylsulfonyl-N-(2,4,6-trimethylphenyl)piperidine-4-carboxamide
CID 5124057
1-naphthalen-2-ylsulfonyl-N-[2-(2,2,2-trifluoroethoxy)phenyl]piperidine-4-carboxamide
CID 46696482
N-(3-chloro-4-methoxyphenyl)-1-naphthalen-2-ylsulfonylpiperidine-4-carboxamide
CID 2992364
1-naphthalen-2-ylsulfonyl-N-pyridin-3-ylpiperidine-4-carboxamide
CID 6458338
N-(2-hydroxyethyl)-1-naphthalen-2-ylsulfonylpiperidine-4-carboxamide
CID 3911093

Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-1-naphthalen-2-ylsulfonylpiperidine-4-carboxamide?
The IUPAC name of N-(2-chlorophenyl)-1-naphthalen-2-ylsulfonylpiperidine-4-carboxamide (CID 26574910) is N-(2-chlorophenyl)-1-naphthalen-2-ylsulfonylpiperidine-4-carboxamide.
What is the SMILES notation for N-(2-chlorophenyl)-1-naphthalen-2-ylsulfonylpiperidine-4-carboxamide?
The canonical SMILES for N-(2-chlorophenyl)-1-naphthalen-2-ylsulfonylpiperidine-4-carboxamide is O=C(Nc1ccccc1Cl)C1CCN(S(=O)(=O)c2ccc3ccccc3c2)CC1.
What is the InChIKey of N-(2-chlorophenyl)-1-naphthalen-2-ylsulfonylpiperidine-4-carboxamide?
The InChIKey is VEYYSDMVIGGWSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21ClN2O3S/c23-20-7-3-4-8-21(20)24-22(26)17-11-13-25(14-12-17)29(27,28)19-10-9-16-5-1-2-6-18(16)15-19/h1-10,15,17H,11-14H2,(H,24,26).
What are the key properties of N-(2-chlorophenyl)-1-naphthalen-2-ylsulfonylpiperidine-4-carboxamide?
N-(2-chlorophenyl)-1-naphthalen-2-ylsulfonylpiperidine-4-carboxamide has a molecular weight of 428.94 g/mol, XLogP of 4.53, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-1-naphthalen-2-ylsulfonylpiperidine-4-carboxamide is sourced from PubChem (CID 26574910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).