N-(6-oxopiperidin-3-yl)naphthalene-1-sulfonamide

C15H16N2O3S — CID 115684185

IUPACN-(6-oxopiperidin-3-yl)naphthalene-1-sulfonamide
SMILESO=C1CCC(NS(=O)(=O)c2cccc3ccccc23)CN1
InChIInChI=1S/C15H16N2O3S/c18-15-9-8-12(10-16-15)17-21(19,20)14-7-3-5-11-4-1-2-6-13(11)14/h1-7,12,17H,8-10H2,(H,16,18)
InChIKeyBTXIZHHJLRUPRK-UHFFFAOYSA-N
MW304.37 g/mol
LogP1.40
Rot. Bonds3

About N-(6-oxopiperidin-3-yl)naphthalene-1-sulfonamide

N-(6-oxopiperidin-3-yl)naphthalene-1-sulfonamide (PubChem CID 115684185) has the molecular formula C15H16N2O3S and a molecular weight of 304.37 g/mol. Its IUPAC name is N-(6-oxopiperidin-3-yl)naphthalene-1-sulfonamide.

Molecular Properties

Compound NameN-(6-oxopiperidin-3-yl)naphthalene-1-sulfonamide
PubChem CID115684185
Molecular FormulaC15H16N2O3S
Molecular Weight304.37 g/mol
Exact Mass304.09
IUPAC NameN-(6-oxopiperidin-3-yl)naphthalene-1-sulfonamide
SMILESO=C1CCC(NS(=O)(=O)c2cccc3ccccc23)CN1
InChIInChI=1S/C15H16N2O3S/c18-15-9-8-12(10-16-15)17-21(19,20)14-7-3-5-11-4-1-2-6-13(11)14/h1-7,12,17H,8-10H2,(H,16,18)
InChIKeyBTXIZHHJLRUPRK-UHFFFAOYSA-N
XLogP1.40
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.37
LogP ≤ 51.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(aminomethyl)-N-(6-oxopiperidin-3-yl)benzenesulfonamide
CID 63661206
2-(3-aminoprop-1-ynyl)-N-(6-oxopiperidin-3-yl)benzenesulfonamide
CID 63661457
N-[(3S)-piperidin-3-yl]naphthalene-1-sulfonamide
CID 104982537
3-chloro-2-fluoro-N-(6-oxopiperidin-3-yl)benzenesulfonamide
CID 62492333
N-cyclohexylnaphthalene-1-sulfonamide
CID 3812052
2-amino-N-(6-oxopiperidin-3-yl)pyridine-3-sulfonamide
CID 63663044
5-(naphthalen-1-ylmethylamino)piperidin-2-one
CID 63378732
N-(6-oxopiperidin-3-yl)naphthalene-1-carboxamide
CID 62491603
3-N-(6-oxopiperidin-3-yl)benzene-1,3-disulfonamide
CID 62491456
2-methyl-N-(5-oxopyrrolidin-3-yl)benzenesulfonamide
CID 105056081
4-bromo-N-(6-oxopiperidin-3-yl)benzenesulfonamide
CID 62490790
2-bromo-N-(5-oxopyrrolidin-3-yl)benzenesulfonamide
CID 104696900

Frequently Asked Questions

What is the IUPAC name of N-(6-oxopiperidin-3-yl)naphthalene-1-sulfonamide?
The IUPAC name of N-(6-oxopiperidin-3-yl)naphthalene-1-sulfonamide (CID 115684185) is N-(6-oxopiperidin-3-yl)naphthalene-1-sulfonamide.
What is the SMILES notation for N-(6-oxopiperidin-3-yl)naphthalene-1-sulfonamide?
The canonical SMILES for N-(6-oxopiperidin-3-yl)naphthalene-1-sulfonamide is O=C1CCC(NS(=O)(=O)c2cccc3ccccc23)CN1.
What is the InChIKey of N-(6-oxopiperidin-3-yl)naphthalene-1-sulfonamide?
The InChIKey is BTXIZHHJLRUPRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O3S/c18-15-9-8-12(10-16-15)17-21(19,20)14-7-3-5-11-4-1-2-6-13(11)14/h1-7,12,17H,8-10H2,(H,16,18).
What are the key properties of N-(6-oxopiperidin-3-yl)naphthalene-1-sulfonamide?
N-(6-oxopiperidin-3-yl)naphthalene-1-sulfonamide has a molecular weight of 304.37 g/mol, XLogP of 1.40, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-oxopiperidin-3-yl)naphthalene-1-sulfonamide is sourced from PubChem (CID 115684185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).