N-(5-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)pyridine-3-sulfonamide

C16H18N2O2S — CID 166242958

IUPACN-(5-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)pyridine-3-sulfonamide
SMILESCc1cccc2c1CCCC2NS(=O)(=O)c1cccnc1
InChIInChI=1S/C16H18N2O2S/c1-12-5-2-8-15-14(12)7-3-9-16(15)18-21(19,20)13-6-4-10-17-11-13/h2,4-6,8,10-11,16,18H,3,7,9H2,1H3
InChIKeyIAKPUMYVGVQWFY-UHFFFAOYSA-N
MW302.40 g/mol
LogP2.75
Rot. Bonds3

About N-(5-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)pyridine-3-sulfonamide

N-(5-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)pyridine-3-sulfonamide (PubChem CID 166242958) has the molecular formula C16H18N2O2S and a molecular weight of 302.40 g/mol. Its IUPAC name is N-(5-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)pyridine-3-sulfonamide.

Molecular Properties

Compound NameN-(5-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)pyridine-3-sulfonamide
PubChem CID166242958
Molecular FormulaC16H18N2O2S
Molecular Weight302.40 g/mol
Exact Mass302.11
IUPAC NameN-(5-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)pyridine-3-sulfonamide
SMILESCc1cccc2c1CCCC2NS(=O)(=O)c1cccnc1
InChIInChI=1S/C16H18N2O2S/c1-12-5-2-8-15-14(12)7-3-9-16(15)18-21(19,20)13-6-4-10-17-11-13/h2,4-6,8,10-11,16,18H,3,7,9H2,1H3
InChIKeyIAKPUMYVGVQWFY-UHFFFAOYSA-N
XLogP2.75
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.40
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(6-amino-1,2,3,4-tetrahydronaphthalen-1-yl)pyridine-3-sulfonamide
CID 116650196
2-[[5-[[4-(3-methyl-2-pyridinyl)phenyl]sulfonylamino]-5,6,7,8-tetrahydronaphthalen-1-yl]oxy]acetic acid
CID 44815333
N-(3-methylcyclohexyl)pyridine-3-sulfonamide
CID 47331340
N-[(7R)-2-(2-methoxyethyl)-4,5,6,7-tetrahydroindazol-7-yl]pyridine-3-sulfonamide
CID 97346805
N-(2-aminocyclopentyl)pyridine-3-sulfonamide
CID 63252124
N-[(7S)-2-(2,2,2-trifluoroethyl)-4,5,6,7-tetrahydroindazol-7-yl]pyridine-3-sulfonamide
CID 97346822
N-(4-cyanocyclohexyl)pyridine-3-sulfonamide
CID 116816994
N-[2-[[(4S)-4,5,6,7-tetrahydro-1-benzofuran-4-yl]amino]ethyl]pyridine-3-sulfonamide
CID 99837876
3,4-dimethyl-N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)benzenesulfonamide
CID 56731325
N-(oxolan-2-ylmethyl)pyridine-3-sulfonamide
CID 110865617
N-(6-oxopiperidin-3-yl)pyridine-3-sulfonamide
CID 63662802
N-(1-methyl-6-oxopiperidin-3-yl)pyridine-3-sulfonamide
CID 131898317

Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)pyridine-3-sulfonamide?
The IUPAC name of N-(5-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)pyridine-3-sulfonamide (CID 166242958) is N-(5-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)pyridine-3-sulfonamide.
What is the SMILES notation for N-(5-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)pyridine-3-sulfonamide?
The canonical SMILES for N-(5-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)pyridine-3-sulfonamide is Cc1cccc2c1CCCC2NS(=O)(=O)c1cccnc1.
What is the InChIKey of N-(5-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)pyridine-3-sulfonamide?
The InChIKey is IAKPUMYVGVQWFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2S/c1-12-5-2-8-15-14(12)7-3-9-16(15)18-21(19,20)13-6-4-10-17-11-13/h2,4-6,8,10-11,16,18H,3,7,9H2,1H3.
What are the key properties of N-(5-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)pyridine-3-sulfonamide?
N-(5-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)pyridine-3-sulfonamide has a molecular weight of 302.40 g/mol, XLogP of 2.75, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-1,2,3,4-tetrahydronaphthalen-1-yl)pyridine-3-sulfonamide is sourced from PubChem (CID 166242958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).