N-[2-(2-methoxyethylamino)ethyl]naphthalene-2-sulfonamide

C15H20N2O3S — CID 83036908

IUPACN-[2-(2-methoxyethylamino)ethyl]naphthalene-2-sulfonamide
SMILESCOCCNCCNS(=O)(=O)c1ccc2ccccc2c1
InChIInChI=1S/C15H20N2O3S/c1-20-11-10-16-8-9-17-21(18,19)15-7-6-13-4-2-3-5-14(13)12-15/h2-7,12,16-17H,8-11H2,1H3
InChIKeyOWRCRBKAUJVJNW-UHFFFAOYSA-N
MW308.40 g/mol
LogP1.35
Rot. Bonds8

About N-[2-(2-methoxyethylamino)ethyl]naphthalene-2-sulfonamide

N-[2-(2-methoxyethylamino)ethyl]naphthalene-2-sulfonamide (PubChem CID 83036908) has the molecular formula C15H20N2O3S and a molecular weight of 308.40 g/mol. Its IUPAC name is N-[2-(2-methoxyethylamino)ethyl]naphthalene-2-sulfonamide.

Molecular Properties

Compound NameN-[2-(2-methoxyethylamino)ethyl]naphthalene-2-sulfonamide
PubChem CID83036908
Molecular FormulaC15H20N2O3S
Molecular Weight308.40 g/mol
Exact Mass308.12
IUPAC NameN-[2-(2-methoxyethylamino)ethyl]naphthalene-2-sulfonamide
SMILESCOCCNCCNS(=O)(=O)c1ccc2ccccc2c1
InChIInChI=1S/C15H20N2O3S/c1-20-11-10-16-8-9-17-21(18,19)15-7-6-13-4-2-3-5-14(13)12-15/h2-7,12,16-17H,8-11H2,1H3
InChIKeyOWRCRBKAUJVJNW-UHFFFAOYSA-N
XLogP1.35
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.40
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[2-(naphthalen-2-ylsulfonylamino)ethyl]naphthalene-2-sulfonamide
CID 30170513
4-methoxy-N-[2-(2-methoxyethylamino)ethyl]benzenesulfonamide;hydrochloride
CID 120717595
3-N-[2-(2-methoxyethylamino)ethyl]benzene-1,3-disulfonamide
CID 83036725
N-[2-(2-methoxyethylamino)ethyl]-4-(4-methoxyphenoxy)benzenesulfonamide;hydrochloride
CID 120717957
N-[2-(2-methoxyethylamino)ethyl]-3-(methoxymethyl)benzenesulfonamide;hydrochloride
CID 120717658
3-fluoro-4-methoxy-N-[2-(2-methoxyethylamino)ethyl]benzenesulfonamide
CID 83039010
methyl 5-[2-(2-methoxyethylamino)ethylsulfamoyl]-2-methylbenzoate
CID 120717694
N-[2-(2-methoxyethylamino)ethyl]-5,6,7,8-tetrahydronaphthalene-2-sulfonamide;hydrochloride
CID 120717803
N-(2-bromoethyl)naphthalene-2-sulfonamide
CID 4737381
3,5-dichloro-N-[2-(2-methoxyethylamino)ethyl]benzenesulfonamide
CID 83039490
N-[3-(ethylsulfonylamino)propyl]naphthalene-2-sulfonamide
CID 49459732
N-[2-(2-methoxyethylamino)ethyl]pyridine-3-sulfonamide
CID 83038911

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-methoxyethylamino)ethyl]naphthalene-2-sulfonamide?
The IUPAC name of N-[2-(2-methoxyethylamino)ethyl]naphthalene-2-sulfonamide (CID 83036908) is N-[2-(2-methoxyethylamino)ethyl]naphthalene-2-sulfonamide.
What is the SMILES notation for N-[2-(2-methoxyethylamino)ethyl]naphthalene-2-sulfonamide?
The canonical SMILES for N-[2-(2-methoxyethylamino)ethyl]naphthalene-2-sulfonamide is COCCNCCNS(=O)(=O)c1ccc2ccccc2c1.
What is the InChIKey of N-[2-(2-methoxyethylamino)ethyl]naphthalene-2-sulfonamide?
The InChIKey is OWRCRBKAUJVJNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O3S/c1-20-11-10-16-8-9-17-21(18,19)15-7-6-13-4-2-3-5-14(13)12-15/h2-7,12,16-17H,8-11H2,1H3.
What are the key properties of N-[2-(2-methoxyethylamino)ethyl]naphthalene-2-sulfonamide?
N-[2-(2-methoxyethylamino)ethyl]naphthalene-2-sulfonamide has a molecular weight of 308.40 g/mol, XLogP of 1.35, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-methoxyethylamino)ethyl]naphthalene-2-sulfonamide is sourced from PubChem (CID 83036908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).