N-(2-methoxyethyl)-N-methylnaphthalene-2-sulfonamide

C14H17NO3S — CID 3841021

IUPACN-(2-methoxyethyl)-N-methylnaphthalene-2-sulfonamide
SMILESCOCCN(C)S(=O)(=O)c1ccc2ccccc2c1
InChIInChI=1S/C14H17NO3S/c1-15(9-10-18-2)19(16,17)14-8-7-12-5-3-4-6-13(12)11-14/h3-8,11H,9-10H2,1-2H3
InChIKeyDVNHMOAAABAAKF-UHFFFAOYSA-N
MW279.36 g/mol
LogP2.11
Rot. Bonds5

About N-(2-methoxyethyl)-N-methylnaphthalene-2-sulfonamide

N-(2-methoxyethyl)-N-methylnaphthalene-2-sulfonamide (PubChem CID 3841021) has the molecular formula C14H17NO3S and a molecular weight of 279.36 g/mol. Its IUPAC name is N-(2-methoxyethyl)-N-methylnaphthalene-2-sulfonamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-N-methylnaphthalene-2-sulfonamide
PubChem CID3841021
Molecular FormulaC14H17NO3S
Molecular Weight279.36 g/mol
Exact Mass279.09
IUPAC NameN-(2-methoxyethyl)-N-methylnaphthalene-2-sulfonamide
SMILESCOCCN(C)S(=O)(=O)c1ccc2ccccc2c1
InChIInChI=1S/C14H17NO3S/c1-15(9-10-18-2)19(16,17)14-8-7-12-5-3-4-6-13(12)11-14/h3-8,11H,9-10H2,1-2H3
InChIKeyDVNHMOAAABAAKF-UHFFFAOYSA-N
XLogP2.11
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.36
LogP ≤ 52.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-N-methylnaphthalene-2-sulfonamide?
The IUPAC name of N-(2-methoxyethyl)-N-methylnaphthalene-2-sulfonamide (CID 3841021) is N-(2-methoxyethyl)-N-methylnaphthalene-2-sulfonamide.
What is the SMILES notation for N-(2-methoxyethyl)-N-methylnaphthalene-2-sulfonamide?
The canonical SMILES for N-(2-methoxyethyl)-N-methylnaphthalene-2-sulfonamide is COCCN(C)S(=O)(=O)c1ccc2ccccc2c1.
What is the InChIKey of N-(2-methoxyethyl)-N-methylnaphthalene-2-sulfonamide?
The InChIKey is DVNHMOAAABAAKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO3S/c1-15(9-10-18-2)19(16,17)14-8-7-12-5-3-4-6-13(12)11-14/h3-8,11H,9-10H2,1-2H3.
What are the key properties of N-(2-methoxyethyl)-N-methylnaphthalene-2-sulfonamide?
N-(2-methoxyethyl)-N-methylnaphthalene-2-sulfonamide has a molecular weight of 279.36 g/mol, XLogP of 2.11, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-N-methylnaphthalene-2-sulfonamide is sourced from PubChem (CID 3841021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).