N-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)methanesulfonamide

C12H17NO3S — CID 78319340

IUPACN-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)methanesulfonamide
SMILESCOc1ccc2c(c1)CCCC2NS(C)(=O)=O
InChIInChI=1S/C12H17NO3S/c1-16-10-6-7-11-9(8-10)4-3-5-12(11)13-17(2,14)15/h6-8,12-13H,3-5H2,1-2H3
InChIKeyWDHJISLXNQYHJA-UHFFFAOYSA-N
MW255.34 g/mol
LogP1.62
Rot. Bonds3

About N-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)methanesulfonamide

N-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)methanesulfonamide (PubChem CID 78319340) has the molecular formula C12H17NO3S and a molecular weight of 255.34 g/mol. Its IUPAC name is N-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)methanesulfonamide.

Molecular Properties

Compound NameN-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)methanesulfonamide
PubChem CID78319340
Molecular FormulaC12H17NO3S
Molecular Weight255.34 g/mol
Exact Mass255.09
IUPAC NameN-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)methanesulfonamide
SMILESCOc1ccc2c(c1)CCCC2NS(C)(=O)=O
InChIInChI=1S/C12H17NO3S/c1-16-10-6-7-11-9(8-10)4-3-5-12(11)13-17(2,14)15/h6-8,12-13H,3-5H2,1-2H3
InChIKeyWDHJISLXNQYHJA-UHFFFAOYSA-N
XLogP1.62
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.34
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1S)-6-(difluoromethoxy)-1,2,3,4-tetrahydronaphthalen-1-yl]methanesulfonamide
CID 94826773
2,2,2-trichloroethyl N-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)sulfamate
CID 24761683
4-methoxy-N-[(1R)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]-2,3-dimethylbenzenesulfonamide
CID 100753581
N-(1,2,3,4-tetrahydronaphthalen-1-yl)methanesulfonamide
CID 4650012
N'-[(1S)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]benzenesulfonohydrazide
CID 124639032
N-(dicyclopropylmethyl)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine
CID 43096402
2-[(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]ethanol
CID 3016750
N-[(1R)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]-2,2-dimethylpropanamide
CID 98004897
6-methoxy-N-(2-methoxy-2-methylpropyl)-1,2,3,4-tetrahydronaphthalen-1-amine
CID 115728733
3-[(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)amino]propan-1-ol
CID 43206577
N-butan-2-yl-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-amine
CID 43190307
(2R)-2-amino-N-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)propanamide
CID 119289450

Frequently Asked Questions

What is the IUPAC name of N-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)methanesulfonamide?
The IUPAC name of N-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)methanesulfonamide (CID 78319340) is N-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)methanesulfonamide.
What is the SMILES notation for N-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)methanesulfonamide?
The canonical SMILES for N-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)methanesulfonamide is COc1ccc2c(c1)CCCC2NS(C)(=O)=O.
What is the InChIKey of N-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)methanesulfonamide?
The InChIKey is WDHJISLXNQYHJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO3S/c1-16-10-6-7-11-9(8-10)4-3-5-12(11)13-17(2,14)15/h6-8,12-13H,3-5H2,1-2H3.
What are the key properties of N-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)methanesulfonamide?
N-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)methanesulfonamide has a molecular weight of 255.34 g/mol, XLogP of 1.62, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)methanesulfonamide is sourced from PubChem (CID 78319340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).