N-(2-hydroxynaphthalen-1-yl)naphthalene-1-sulfonamide

C20H15NO3S — CID 16738608

IUPACN-(2-hydroxynaphthalen-1-yl)naphthalene-1-sulfonamide
SMILESO=S(=O)(Nc1c(O)ccc2ccccc12)c1cccc2ccccc12
InChIInChI=1S/C20H15NO3S/c22-18-13-12-15-7-2-4-10-17(15)20(18)21-25(23,24)19-11-5-8-14-6-1-3-9-16(14)19/h1-13,21-22H
InChIKeyFVNNRRJGTQAXGH-UHFFFAOYSA-N
MW349.41 g/mol
LogP4.50
Rot. Bonds3

About N-(2-hydroxynaphthalen-1-yl)naphthalene-1-sulfonamide

N-(2-hydroxynaphthalen-1-yl)naphthalene-1-sulfonamide (PubChem CID 16738608) has the molecular formula C20H15NO3S and a molecular weight of 349.41 g/mol. Its IUPAC name is N-(2-hydroxynaphthalen-1-yl)naphthalene-1-sulfonamide.

Molecular Properties

Compound NameN-(2-hydroxynaphthalen-1-yl)naphthalene-1-sulfonamide
PubChem CID16738608
Molecular FormulaC20H15NO3S
Molecular Weight349.41 g/mol
Exact Mass349.08
IUPAC NameN-(2-hydroxynaphthalen-1-yl)naphthalene-1-sulfonamide
SMILESO=S(=O)(Nc1c(O)ccc2ccccc12)c1cccc2ccccc12
InChIInChI=1S/C20H15NO3S/c22-18-13-12-15-7-2-4-10-17(15)20(18)21-25(23,24)19-11-5-8-14-6-1-3-9-16(14)19/h1-13,21-22H
InChIKeyFVNNRRJGTQAXGH-UHFFFAOYSA-N
XLogP4.50
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.41
LogP ≤ 54.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

C.I. Acid Orange 7
CID 135442941
1-Naphthalenesulfonic acid, 3-hydroxy-4-(2-(1-hydroxy-2-naphthalenyl)diazenyl)-
CID 19098
C.I. Acid Orange 10
CID 16015
FD&C yellow 6
CID 17730
C.I. Acid Red 18, trisodium salt
CID 17466
1-Naphthalenesulfonic acid, 4-[2-(2-hydroxy-1-naphthalenyl)diazenyl]-
CID 15454
C.I. Pigment Red 49
CID 135487615
1-Naphthalenesulfonic acid, 3-hydroxy-4-((2-hydroxy-1-naphthalenyl)azo)-, monosodium salt
CID 135465074
6-Hydroxy-5-(4-sulfophenylazo)-2-naphthalenesulfonic acid
CID 17731
3-Hydroxy-4-(6-hydroxy-m-tolylazo)naphthalene-1-sulphonic acid
CID 2530
1-Amino-2-naphthol-4-sulfonic acid
CID 8316
1-Naphthalenesulfonic acid, 2-[2-(2-hydroxy-6-sulfo-1-naphthalenyl)diazenyl]-, strontium salt (1:1)
CID 135565130

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxynaphthalen-1-yl)naphthalene-1-sulfonamide?
The IUPAC name of N-(2-hydroxynaphthalen-1-yl)naphthalene-1-sulfonamide (CID 16738608) is N-(2-hydroxynaphthalen-1-yl)naphthalene-1-sulfonamide.
What is the SMILES notation for N-(2-hydroxynaphthalen-1-yl)naphthalene-1-sulfonamide?
The canonical SMILES for N-(2-hydroxynaphthalen-1-yl)naphthalene-1-sulfonamide is O=S(=O)(Nc1c(O)ccc2ccccc12)c1cccc2ccccc12.
What is the InChIKey of N-(2-hydroxynaphthalen-1-yl)naphthalene-1-sulfonamide?
The InChIKey is FVNNRRJGTQAXGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15NO3S/c22-18-13-12-15-7-2-4-10-17(15)20(18)21-25(23,24)19-11-5-8-14-6-1-3-9-16(14)19/h1-13,21-22H.
What are the key properties of N-(2-hydroxynaphthalen-1-yl)naphthalene-1-sulfonamide?
N-(2-hydroxynaphthalen-1-yl)naphthalene-1-sulfonamide has a molecular weight of 349.41 g/mol, XLogP of 4.50, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxynaphthalen-1-yl)naphthalene-1-sulfonamide is sourced from PubChem (CID 16738608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).