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

C24H26N2O3S — CID 26208569

IUPACN-(2-ethylphenyl)-1-naphthalen-2-ylsulfonylpiperidine-4-carboxamide
SMILESCCc1ccccc1NC(=O)C1CCN(S(=O)(=O)c2ccc3ccccc3c2)CC1
InChIInChI=1S/C24H26N2O3S/c1-2-18-7-5-6-10-23(18)25-24(27)20-13-15-26(16-14-20)30(28,29)22-12-11-19-8-3-4-9-21(19)17-22/h3-12,17,20H,2,13-16H2,1H3,(H,25,27)
InChIKeyZIKUAJLRQHAJJJ-UHFFFAOYSA-N
MW422.55 g/mol
LogP4.44
Rot. Bonds5

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

N-(2-ethylphenyl)-1-naphthalen-2-ylsulfonylpiperidine-4-carboxamide (PubChem CID 26208569) has the molecular formula C24H26N2O3S and a molecular weight of 422.55 g/mol. Its IUPAC name is N-(2-ethylphenyl)-1-naphthalen-2-ylsulfonylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-(2-ethylphenyl)-1-naphthalen-2-ylsulfonylpiperidine-4-carboxamide
PubChem CID26208569
Molecular FormulaC24H26N2O3S
Molecular Weight422.55 g/mol
Exact Mass422.17
IUPAC NameN-(2-ethylphenyl)-1-naphthalen-2-ylsulfonylpiperidine-4-carboxamide
SMILESCCc1ccccc1NC(=O)C1CCN(S(=O)(=O)c2ccc3ccccc3c2)CC1
InChIInChI=1S/C24H26N2O3S/c1-2-18-7-5-6-10-23(18)25-24(27)20-13-15-26(16-14-20)30(28,29)22-12-11-19-8-3-4-9-21(19)17-22/h3-12,17,20H,2,13-16H2,1H3,(H,25,27)
InChIKeyZIKUAJLRQHAJJJ-UHFFFAOYSA-N
XLogP4.44
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500422.55
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-chlorophenyl)-1-naphthalen-2-ylsulfonylpiperidine-4-carboxamide
CID 26574910
N-(3-ethylphenyl)-1-naphthalen-2-ylsulfonylpiperidine-4-carboxamide
CID 26795871
N-(4-acetamidophenyl)-1-naphthalen-2-ylsulfonylpiperidine-4-carboxamide
CID 26499572
N-(4-bromo-2-ethyl-6-methylphenyl)-1-naphthalen-2-ylsulfonylpiperidine-4-carboxamide
CID 100795824
N-(2-bromo-4-methylphenyl)-1-naphthalen-2-ylsulfonylpiperidine-4-carboxamide
CID 26774997
1-naphthalen-2-ylsulfonyl-N-(2,4,6-trimethylphenyl)piperidine-4-carboxamide
CID 5124057
N-(6-acetyl-1,3-benzodioxol-5-yl)-1-naphthalen-2-ylsulfonylpiperidine-4-carboxamide
CID 31289668
1-naphthalen-2-ylsulfonyl-N-[2-(2,2,2-trifluoroethoxy)phenyl]piperidine-4-carboxamide
CID 46696482
1-naphthalen-2-ylsulfonyl-N-prop-2-ynylpiperidine-4-carboxamide
CID 27741102
N-[[2-(diethylaminomethyl)phenyl]methyl]-1-naphthalen-2-ylsulfonylpiperidine-4-carboxamide
CID 41438993
N-(2-ethylphenyl)-1-[[(2R)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]sulfonyl]piperidine-4-carboxamide
CID 95068584
N-(2-ethylphenyl)-1-[(3-oxo-4H-1,4-benzoxazin-6-yl)sulfonyl]piperidine-4-carboxamide
CID 22548692

Frequently Asked Questions

What is the IUPAC name of N-(2-ethylphenyl)-1-naphthalen-2-ylsulfonylpiperidine-4-carboxamide?
The IUPAC name of N-(2-ethylphenyl)-1-naphthalen-2-ylsulfonylpiperidine-4-carboxamide (CID 26208569) is N-(2-ethylphenyl)-1-naphthalen-2-ylsulfonylpiperidine-4-carboxamide.
What is the SMILES notation for N-(2-ethylphenyl)-1-naphthalen-2-ylsulfonylpiperidine-4-carboxamide?
The canonical SMILES for N-(2-ethylphenyl)-1-naphthalen-2-ylsulfonylpiperidine-4-carboxamide is CCc1ccccc1NC(=O)C1CCN(S(=O)(=O)c2ccc3ccccc3c2)CC1.
What is the InChIKey of N-(2-ethylphenyl)-1-naphthalen-2-ylsulfonylpiperidine-4-carboxamide?
The InChIKey is ZIKUAJLRQHAJJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N2O3S/c1-2-18-7-5-6-10-23(18)25-24(27)20-13-15-26(16-14-20)30(28,29)22-12-11-19-8-3-4-9-21(19)17-22/h3-12,17,20H,2,13-16H2,1H3,(H,25,27).
What are the key properties of N-(2-ethylphenyl)-1-naphthalen-2-ylsulfonylpiperidine-4-carboxamide?
N-(2-ethylphenyl)-1-naphthalen-2-ylsulfonylpiperidine-4-carboxamide has a molecular weight of 422.55 g/mol, XLogP of 4.44, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylphenyl)-1-naphthalen-2-ylsulfonylpiperidine-4-carboxamide is sourced from PubChem (CID 26208569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).