N-(1H-indol-5-yl)naphthalene-2-sulfonamide

C18H14N2O2S — CID 3718023

IUPACN-(1H-indol-5-yl)naphthalene-2-sulfonamide
SMILESO=S(=O)(Nc1ccc2[nH]ccc2c1)c1ccc2ccccc2c1
InChIInChI=1S/C18H14N2O2S/c21-23(22,17-7-5-13-3-1-2-4-14(13)12-17)20-16-6-8-18-15(11-16)9-10-19-18/h1-12,19-20H
InChIKeyZIHYEEVILKUGGV-UHFFFAOYSA-N
MW322.39 g/mol
LogP4.12
Rot. Bonds3

About N-(1H-indol-5-yl)naphthalene-2-sulfonamide

N-(1H-indol-5-yl)naphthalene-2-sulfonamide (PubChem CID 3718023) has the molecular formula C18H14N2O2S and a molecular weight of 322.39 g/mol. Its IUPAC name is N-(1H-indol-5-yl)naphthalene-2-sulfonamide.

Molecular Properties

Compound NameN-(1H-indol-5-yl)naphthalene-2-sulfonamide
PubChem CID3718023
Molecular FormulaC18H14N2O2S
Molecular Weight322.39 g/mol
Exact Mass322.08
IUPAC NameN-(1H-indol-5-yl)naphthalene-2-sulfonamide
SMILESO=S(=O)(Nc1ccc2[nH]ccc2c1)c1ccc2ccccc2c1
InChIInChI=1S/C18H14N2O2S/c21-23(22,17-7-5-13-3-1-2-4-14(13)12-17)20-16-6-8-18-15(11-16)9-10-19-18/h1-12,19-20H
InChIKeyZIHYEEVILKUGGV-UHFFFAOYSA-N
XLogP4.12
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.39
LogP ≤ 54.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(1H-indol-5-yl)naphthalene-2-sulfonamide?
The IUPAC name of N-(1H-indol-5-yl)naphthalene-2-sulfonamide (CID 3718023) is N-(1H-indol-5-yl)naphthalene-2-sulfonamide.
What is the SMILES notation for N-(1H-indol-5-yl)naphthalene-2-sulfonamide?
The canonical SMILES for N-(1H-indol-5-yl)naphthalene-2-sulfonamide is O=S(=O)(Nc1ccc2[nH]ccc2c1)c1ccc2ccccc2c1.
What is the InChIKey of N-(1H-indol-5-yl)naphthalene-2-sulfonamide?
The InChIKey is ZIHYEEVILKUGGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N2O2S/c21-23(22,17-7-5-13-3-1-2-4-14(13)12-17)20-16-6-8-18-15(11-16)9-10-19-18/h1-12,19-20H.
What are the key properties of N-(1H-indol-5-yl)naphthalene-2-sulfonamide?
N-(1H-indol-5-yl)naphthalene-2-sulfonamide has a molecular weight of 322.39 g/mol, XLogP of 4.12, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-indol-5-yl)naphthalene-2-sulfonamide is sourced from PubChem (CID 3718023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).