N-(3-pyrazin-2-yloxyphenyl)-3,4-dihydronaphthalene-2-sulfonamide

C20H17N3O3S — CID 46437368

IUPACN-(3-pyrazin-2-yloxyphenyl)-3,4-dihydronaphthalene-2-sulfonamide
SMILESO=S(=O)(Nc1cccc(Oc2cnccn2)c1)C1=Cc2ccccc2CC1
InChIInChI=1S/C20H17N3O3S/c24-27(25,19-9-8-15-4-1-2-5-16(15)12-19)23-17-6-3-7-18(13-17)26-20-14-21-10-11-22-20/h1-7,10-14,23H,8-9H2
InChIKeyWOGUKJIWDPDTKK-UHFFFAOYSA-N
MW379.44 g/mol
LogP4.00
Rot. Bonds5

About N-(3-pyrazin-2-yloxyphenyl)-3,4-dihydronaphthalene-2-sulfonamide

N-(3-pyrazin-2-yloxyphenyl)-3,4-dihydronaphthalene-2-sulfonamide (PubChem CID 46437368) has the molecular formula C20H17N3O3S and a molecular weight of 379.44 g/mol. Its IUPAC name is N-(3-pyrazin-2-yloxyphenyl)-3,4-dihydronaphthalene-2-sulfonamide.

Molecular Properties

Compound NameN-(3-pyrazin-2-yloxyphenyl)-3,4-dihydronaphthalene-2-sulfonamide
PubChem CID46437368
Molecular FormulaC20H17N3O3S
Molecular Weight379.44 g/mol
Exact Mass379.10
IUPAC NameN-(3-pyrazin-2-yloxyphenyl)-3,4-dihydronaphthalene-2-sulfonamide
SMILESO=S(=O)(Nc1cccc(Oc2cnccn2)c1)C1=Cc2ccccc2CC1
InChIInChI=1S/C20H17N3O3S/c24-27(25,19-9-8-15-4-1-2-5-16(15)12-19)23-17-6-3-7-18(13-17)26-20-14-21-10-11-22-20/h1-7,10-14,23H,8-9H2
InChIKeyWOGUKJIWDPDTKK-UHFFFAOYSA-N
XLogP4.00
TPSA81.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.44
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(3-pyrazin-2-yloxyphenyl)-3,4-dihydronaphthalene-2-sulfonamide?
The IUPAC name of N-(3-pyrazin-2-yloxyphenyl)-3,4-dihydronaphthalene-2-sulfonamide (CID 46437368) is N-(3-pyrazin-2-yloxyphenyl)-3,4-dihydronaphthalene-2-sulfonamide.
What is the SMILES notation for N-(3-pyrazin-2-yloxyphenyl)-3,4-dihydronaphthalene-2-sulfonamide?
The canonical SMILES for N-(3-pyrazin-2-yloxyphenyl)-3,4-dihydronaphthalene-2-sulfonamide is O=S(=O)(Nc1cccc(Oc2cnccn2)c1)C1=Cc2ccccc2CC1.
What is the InChIKey of N-(3-pyrazin-2-yloxyphenyl)-3,4-dihydronaphthalene-2-sulfonamide?
The InChIKey is WOGUKJIWDPDTKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N3O3S/c24-27(25,19-9-8-15-4-1-2-5-16(15)12-19)23-17-6-3-7-18(13-17)26-20-14-21-10-11-22-20/h1-7,10-14,23H,8-9H2.
What are the key properties of N-(3-pyrazin-2-yloxyphenyl)-3,4-dihydronaphthalene-2-sulfonamide?
N-(3-pyrazin-2-yloxyphenyl)-3,4-dihydronaphthalene-2-sulfonamide has a molecular weight of 379.44 g/mol, XLogP of 4.00, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-pyrazin-2-yloxyphenyl)-3,4-dihydronaphthalene-2-sulfonamide is sourced from PubChem (CID 46437368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).