N-(2-morpholin-4-ylethyl)naphthalene-2-sulfonamide

C16H20N2O3S — CID 670907

IUPACN-(2-morpholin-4-ylethyl)naphthalene-2-sulfonamide
SMILESO=S(=O)(NCCN1CCOCC1)c1ccc2ccccc2c1
InChIInChI=1S/C16H20N2O3S/c19-22(20,17-7-8-18-9-11-21-12-10-18)16-6-5-14-3-1-2-4-15(14)13-16/h1-6,13,17H,7-12H2
InChIKeyMMIZHMLHHTVIAJ-UHFFFAOYSA-N
MW320.41 g/mol
LogP1.45
Rot. Bonds5

About N-(2-morpholin-4-ylethyl)naphthalene-2-sulfonamide

N-(2-morpholin-4-ylethyl)naphthalene-2-sulfonamide (PubChem CID 670907) has the molecular formula C16H20N2O3S and a molecular weight of 320.41 g/mol. Its IUPAC name is N-(2-morpholin-4-ylethyl)naphthalene-2-sulfonamide.

Molecular Properties

Compound NameN-(2-morpholin-4-ylethyl)naphthalene-2-sulfonamide
PubChem CID670907
Molecular FormulaC16H20N2O3S
Molecular Weight320.41 g/mol
Exact Mass320.12
IUPAC NameN-(2-morpholin-4-ylethyl)naphthalene-2-sulfonamide
SMILESO=S(=O)(NCCN1CCOCC1)c1ccc2ccccc2c1
InChIInChI=1S/C16H20N2O3S/c19-22(20,17-7-8-18-9-11-21-12-10-18)16-6-5-14-3-1-2-4-15(14)13-16/h1-6,13,17H,7-12H2
InChIKeyMMIZHMLHHTVIAJ-UHFFFAOYSA-N
XLogP1.45
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.41
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-morpholin-4-ylethyl)naphthalene-2-sulfonamide?
The IUPAC name of N-(2-morpholin-4-ylethyl)naphthalene-2-sulfonamide (CID 670907) is N-(2-morpholin-4-ylethyl)naphthalene-2-sulfonamide.
What is the SMILES notation for N-(2-morpholin-4-ylethyl)naphthalene-2-sulfonamide?
The canonical SMILES for N-(2-morpholin-4-ylethyl)naphthalene-2-sulfonamide is O=S(=O)(NCCN1CCOCC1)c1ccc2ccccc2c1.
What is the InChIKey of N-(2-morpholin-4-ylethyl)naphthalene-2-sulfonamide?
The InChIKey is MMIZHMLHHTVIAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O3S/c19-22(20,17-7-8-18-9-11-21-12-10-18)16-6-5-14-3-1-2-4-15(14)13-16/h1-6,13,17H,7-12H2.
What are the key properties of N-(2-morpholin-4-ylethyl)naphthalene-2-sulfonamide?
N-(2-morpholin-4-ylethyl)naphthalene-2-sulfonamide has a molecular weight of 320.41 g/mol, XLogP of 1.45, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-morpholin-4-ylethyl)naphthalene-2-sulfonamide is sourced from PubChem (CID 670907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).