4-chloro-N-pyridin-2-ylnaphthalene-1-sulfonamide

C15H11ClN2O2S — CID 881482

IUPAC4-chloro-N-pyridin-2-ylnaphthalene-1-sulfonamide
SMILESO=S(=O)(Nc1ccccn1)c1ccc(Cl)c2ccccc12
InChIInChI=1S/C15H11ClN2O2S/c16-13-8-9-14(12-6-2-1-5-11(12)13)21(19,20)18-15-7-3-4-10-17-15/h1-10H,(H,17,18)
InChIKeyQOZADSWVTBGRKS-UHFFFAOYSA-N
MW318.79 g/mol
LogP3.69
Rot. Bonds3

About 4-chloro-N-pyridin-2-ylnaphthalene-1-sulfonamide

4-chloro-N-pyridin-2-ylnaphthalene-1-sulfonamide (PubChem CID 881482) has the molecular formula C15H11ClN2O2S and a molecular weight of 318.79 g/mol. Its IUPAC name is 4-chloro-N-pyridin-2-ylnaphthalene-1-sulfonamide.

Molecular Properties

Compound Name4-chloro-N-pyridin-2-ylnaphthalene-1-sulfonamide
PubChem CID881482
Molecular FormulaC15H11ClN2O2S
Molecular Weight318.79 g/mol
Exact Mass318.02
IUPAC Name4-chloro-N-pyridin-2-ylnaphthalene-1-sulfonamide
SMILESO=S(=O)(Nc1ccccn1)c1ccc(Cl)c2ccccc12
InChIInChI=1S/C15H11ClN2O2S/c16-13-8-9-14(12-6-2-1-5-11(12)13)21(19,20)18-15-7-3-4-10-17-15/h1-10H,(H,17,18)
InChIKeyQOZADSWVTBGRKS-UHFFFAOYSA-N
XLogP3.69
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.79
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-pyridin-2-ylnaphthalene-1-sulfonamide?
The IUPAC name of 4-chloro-N-pyridin-2-ylnaphthalene-1-sulfonamide (CID 881482) is 4-chloro-N-pyridin-2-ylnaphthalene-1-sulfonamide.
What is the SMILES notation for 4-chloro-N-pyridin-2-ylnaphthalene-1-sulfonamide?
The canonical SMILES for 4-chloro-N-pyridin-2-ylnaphthalene-1-sulfonamide is O=S(=O)(Nc1ccccn1)c1ccc(Cl)c2ccccc12.
What is the InChIKey of 4-chloro-N-pyridin-2-ylnaphthalene-1-sulfonamide?
The InChIKey is QOZADSWVTBGRKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11ClN2O2S/c16-13-8-9-14(12-6-2-1-5-11(12)13)21(19,20)18-15-7-3-4-10-17-15/h1-10H,(H,17,18).
What are the key properties of 4-chloro-N-pyridin-2-ylnaphthalene-1-sulfonamide?
4-chloro-N-pyridin-2-ylnaphthalene-1-sulfonamide has a molecular weight of 318.79 g/mol, XLogP of 3.69, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-pyridin-2-ylnaphthalene-1-sulfonamide is sourced from PubChem (CID 881482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).