N-[[5-(furan-2-yl)-3-pyridinyl]methyl]naphthalene-2-sulfonamide

C20H16N2O3S — CID 121197322

IUPACN-[[5-(furan-2-yl)-3-pyridinyl]methyl]naphthalene-2-sulfonamide
SMILESO=S(=O)(NCc1cncc(-c2ccco2)c1)c1ccc2ccccc2c1
InChIInChI=1S/C20H16N2O3S/c23-26(24,19-8-7-16-4-1-2-5-17(16)11-19)22-13-15-10-18(14-21-12-15)20-6-3-9-25-20/h1-12,14,22H,13H2
InChIKeyIECDDRPRPXJBSS-UHFFFAOYSA-N
MW364.43 g/mol
LogP3.97
Rot. Bonds5

About N-[[5-(furan-2-yl)-3-pyridinyl]methyl]naphthalene-2-sulfonamide

N-[[5-(furan-2-yl)-3-pyridinyl]methyl]naphthalene-2-sulfonamide (PubChem CID 121197322) has the molecular formula C20H16N2O3S and a molecular weight of 364.43 g/mol. Its IUPAC name is N-[[5-(furan-2-yl)-3-pyridinyl]methyl]naphthalene-2-sulfonamide.

Molecular Properties

Compound NameN-[[5-(furan-2-yl)-3-pyridinyl]methyl]naphthalene-2-sulfonamide
PubChem CID121197322
Molecular FormulaC20H16N2O3S
Molecular Weight364.43 g/mol
Exact Mass364.09
IUPAC NameN-[[5-(furan-2-yl)-3-pyridinyl]methyl]naphthalene-2-sulfonamide
SMILESO=S(=O)(NCc1cncc(-c2ccco2)c1)c1ccc2ccccc2c1
InChIInChI=1S/C20H16N2O3S/c23-26(24,19-8-7-16-4-1-2-5-17(16)11-19)22-13-15-10-18(14-21-12-15)20-6-3-9-25-20/h1-12,14,22H,13H2
InChIKeyIECDDRPRPXJBSS-UHFFFAOYSA-N
XLogP3.97
TPSA72.20 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.43
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[5-(furan-2-yl)-3-pyridinyl]methyl]-3,4-dimethylbenzenesulfonamide
CID 121022709
4-chloro-N-[[5-(furan-2-yl)-3-pyridinyl]methyl]-3-(trifluoromethyl)benzenesulfonamide
CID 121197330
4-ethoxy-N-[[5-(furan-2-yl)-3-pyridinyl]methyl]-3-methylbenzenesulfonamide
CID 121197305
N-[[5-(furan-2-yl)-3-pyridinyl]methyl]ethanesulfonamide
CID 121197266
N-[[5-(furan-2-yl)-3-pyridinyl]methyl]-2,3,5,6-tetramethylbenzenesulfonamide
CID 121197304
N-[[5-(furan-2-yl)-3-pyridinyl]methyl]quinoline-2-carboxamide
CID 121197126
N-[[5-(furan-2-yl)-3-pyridinyl]methyl]-2-(4-methoxyphenyl)acetamide
CID 121196995
3-[[5-(furan-2-yl)-3-pyridinyl]methyl]-1,1-dimethylurea
CID 121197182
N-[2-(naphthalen-2-ylsulfonylamino)ethyl]naphthalene-2-sulfonamide
CID 30170513
N-[(4-tert-butylphenyl)methyl]naphthalene-2-sulfonamide
CID 3780847
N-[[5-(furan-2-yl)-3-pyridinyl]methyl]-2-phenylmethoxyacetamide
CID 121197178
N-[[5-(furan-2-yl)-3-pyridinyl]methyl]-2-pyrrol-1-ylacetamide
CID 121197083

Frequently Asked Questions

What is the IUPAC name of N-[[5-(furan-2-yl)-3-pyridinyl]methyl]naphthalene-2-sulfonamide?
The IUPAC name of N-[[5-(furan-2-yl)-3-pyridinyl]methyl]naphthalene-2-sulfonamide (CID 121197322) is N-[[5-(furan-2-yl)-3-pyridinyl]methyl]naphthalene-2-sulfonamide.
What is the SMILES notation for N-[[5-(furan-2-yl)-3-pyridinyl]methyl]naphthalene-2-sulfonamide?
The canonical SMILES for N-[[5-(furan-2-yl)-3-pyridinyl]methyl]naphthalene-2-sulfonamide is O=S(=O)(NCc1cncc(-c2ccco2)c1)c1ccc2ccccc2c1.
What is the InChIKey of N-[[5-(furan-2-yl)-3-pyridinyl]methyl]naphthalene-2-sulfonamide?
The InChIKey is IECDDRPRPXJBSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N2O3S/c23-26(24,19-8-7-16-4-1-2-5-17(16)11-19)22-13-15-10-18(14-21-12-15)20-6-3-9-25-20/h1-12,14,22H,13H2.
What are the key properties of N-[[5-(furan-2-yl)-3-pyridinyl]methyl]naphthalene-2-sulfonamide?
N-[[5-(furan-2-yl)-3-pyridinyl]methyl]naphthalene-2-sulfonamide has a molecular weight of 364.43 g/mol, XLogP of 3.97, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(furan-2-yl)-3-pyridinyl]methyl]naphthalene-2-sulfonamide is sourced from PubChem (CID 121197322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).