N-(1-methylpiperidin-3-yl)naphthalene-1-sulfonamide

C16H20N2O2S — CID 115684087

IUPACN-(1-methylpiperidin-3-yl)naphthalene-1-sulfonamide
SMILESCN1CCCC(NS(=O)(=O)c2cccc3ccccc23)C1
InChIInChI=1S/C16H20N2O2S/c1-18-11-5-8-14(12-18)17-21(19,20)16-10-4-7-13-6-2-3-9-15(13)16/h2-4,6-7,9-10,14,17H,5,8,11-12H2,1H3
InChIKeyTZOZDJJDIXPKLK-UHFFFAOYSA-N
MW304.41 g/mol
LogP2.21
Rot. Bonds3

About N-(1-methylpiperidin-3-yl)naphthalene-1-sulfonamide

N-(1-methylpiperidin-3-yl)naphthalene-1-sulfonamide (PubChem CID 115684087) has the molecular formula C16H20N2O2S and a molecular weight of 304.41 g/mol. Its IUPAC name is N-(1-methylpiperidin-3-yl)naphthalene-1-sulfonamide.

Molecular Properties

Compound NameN-(1-methylpiperidin-3-yl)naphthalene-1-sulfonamide
PubChem CID115684087
Molecular FormulaC16H20N2O2S
Molecular Weight304.41 g/mol
Exact Mass304.12
IUPAC NameN-(1-methylpiperidin-3-yl)naphthalene-1-sulfonamide
SMILESCN1CCCC(NS(=O)(=O)c2cccc3ccccc23)C1
InChIInChI=1S/C16H20N2O2S/c1-18-11-5-8-14(12-18)17-21(19,20)16-10-4-7-13-6-2-3-9-15(13)16/h2-4,6-7,9-10,14,17H,5,8,11-12H2,1H3
InChIKeyTZOZDJJDIXPKLK-UHFFFAOYSA-N
XLogP2.21
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.41
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(ethylamino)-N-(1-methylpiperidin-3-yl)benzenesulfonamide
CID 62146904
2-(aminomethyl)-N-(1-methylpiperidin-3-yl)benzenesulfonamide
CID 61222385
N-cyclohexylnaphthalene-1-sulfonamide
CID 3812052
N-[(3S)-piperidin-3-yl]naphthalene-1-sulfonamide
CID 104982537
N-(1-benzylpyrrolidin-3-yl)naphthalene-1-sulfonamide
CID 3791981
4-(aminomethyl)-N-(1-methylpiperidin-3-yl)benzenesulfonamide
CID 61222384
3-[(1-methylpiperidin-3-yl)sulfamoyl]pyridine-2-carbothioamide
CID 106596742
N-methyl-1-naphthalen-1-ylsulfonylpiperidin-3-amine;hydrochloride
CID 120714484
N-(1-ethylpiperidin-3-yl)-2-hydroxybenzenesulfonamide
CID 81242229
N-[(1R,2R)-2-hydroxycyclohexyl]naphthalene-1-sulfonamide
CID 104922343
N-methyl-1-(1-naphthalen-1-ylsulfonylpiperidin-3-yl)methanamine
CID 119961093
N-[1-(2-methylpyrazol-3-yl)-2-oxopiperidin-3-yl]naphthalene-1-sulfonamide
CID 129000198

Frequently Asked Questions

What is the IUPAC name of N-(1-methylpiperidin-3-yl)naphthalene-1-sulfonamide?
The IUPAC name of N-(1-methylpiperidin-3-yl)naphthalene-1-sulfonamide (CID 115684087) is N-(1-methylpiperidin-3-yl)naphthalene-1-sulfonamide.
What is the SMILES notation for N-(1-methylpiperidin-3-yl)naphthalene-1-sulfonamide?
The canonical SMILES for N-(1-methylpiperidin-3-yl)naphthalene-1-sulfonamide is CN1CCCC(NS(=O)(=O)c2cccc3ccccc23)C1.
What is the InChIKey of N-(1-methylpiperidin-3-yl)naphthalene-1-sulfonamide?
The InChIKey is TZOZDJJDIXPKLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2S/c1-18-11-5-8-14(12-18)17-21(19,20)16-10-4-7-13-6-2-3-9-15(13)16/h2-4,6-7,9-10,14,17H,5,8,11-12H2,1H3.
What are the key properties of N-(1-methylpiperidin-3-yl)naphthalene-1-sulfonamide?
N-(1-methylpiperidin-3-yl)naphthalene-1-sulfonamide has a molecular weight of 304.41 g/mol, XLogP of 2.21, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methylpiperidin-3-yl)naphthalene-1-sulfonamide is sourced from PubChem (CID 115684087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).