N-(4-methyl-1,3-oxazol-2-yl)naphthalene-1-sulfonamide

C14H12N2O3S — CID 103948575

IUPACN-(4-methyl-1,3-oxazol-2-yl)naphthalene-1-sulfonamide
SMILESCc1coc(NS(=O)(=O)c2cccc3ccccc23)n1
InChIInChI=1S/C14H12N2O3S/c1-10-9-19-14(15-10)16-20(17,18)13-8-4-6-11-5-2-3-7-12(11)13/h2-9H,1H3,(H,15,16)
InChIKeyURYCHCPGGITLJB-UHFFFAOYSA-N
MW288.33 g/mol
LogP2.94
Rot. Bonds3

About N-(4-methyl-1,3-oxazol-2-yl)naphthalene-1-sulfonamide

N-(4-methyl-1,3-oxazol-2-yl)naphthalene-1-sulfonamide (PubChem CID 103948575) has the molecular formula C14H12N2O3S and a molecular weight of 288.33 g/mol. Its IUPAC name is N-(4-methyl-1,3-oxazol-2-yl)naphthalene-1-sulfonamide.

Molecular Properties

Compound NameN-(4-methyl-1,3-oxazol-2-yl)naphthalene-1-sulfonamide
PubChem CID103948575
Molecular FormulaC14H12N2O3S
Molecular Weight288.33 g/mol
Exact Mass288.06
IUPAC NameN-(4-methyl-1,3-oxazol-2-yl)naphthalene-1-sulfonamide
SMILESCc1coc(NS(=O)(=O)c2cccc3ccccc23)n1
InChIInChI=1S/C14H12N2O3S/c1-10-9-19-14(15-10)16-20(17,18)13-8-4-6-11-5-2-3-7-12(11)13/h2-9H,1H3,(H,15,16)
InChIKeyURYCHCPGGITLJB-UHFFFAOYSA-N
XLogP2.94
TPSA72.20 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.33
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-methyl-1,2-oxazol-5-yl)naphthalene-1-sulfonamide
CID 107860458
N-(5-methylpyrazin-2-yl)naphthalene-1-sulfonamide
CID 67573141
N-pyrimidin-2-ylnaphthalene-1-sulfonamide
CID 75483860
N-phenylnaphthalene-1-sulfonamide
CID 3816137
N-(4-methyl-3-pyridinyl)naphthalene-1-sulfonamide
CID 115685376
N-(4-methyl-1,3-oxazol-2-yl)-1H-pyrazole-5-sulfonamide
CID 102693424
N-(3-tert-butyl-1-methylpyrazol-5-yl)naphthalene-1-sulfonamide
CID 5220322
N-(methylaminomethyl)naphthalene-1-sulfonamide
CID 173069898
N-(4-anilinophenyl)naphthalene-1-sulfonamide
CID 86182181
N-[4,5-dibromo-2-(naphthalen-1-ylsulfonylamino)phenyl]naphthalene-1-sulfonamide
CID 139947697
N-(6-chloro-2-iodo-3-pyridinyl)naphthalene-1-sulfonamide
CID 87538260
N-(2-ethoxypyrimidin-5-yl)naphthalene-1-sulfonamide
CID 122302123

Frequently Asked Questions

What is the IUPAC name of N-(4-methyl-1,3-oxazol-2-yl)naphthalene-1-sulfonamide?
The IUPAC name of N-(4-methyl-1,3-oxazol-2-yl)naphthalene-1-sulfonamide (CID 103948575) is N-(4-methyl-1,3-oxazol-2-yl)naphthalene-1-sulfonamide.
What is the SMILES notation for N-(4-methyl-1,3-oxazol-2-yl)naphthalene-1-sulfonamide?
The canonical SMILES for N-(4-methyl-1,3-oxazol-2-yl)naphthalene-1-sulfonamide is Cc1coc(NS(=O)(=O)c2cccc3ccccc23)n1.
What is the InChIKey of N-(4-methyl-1,3-oxazol-2-yl)naphthalene-1-sulfonamide?
The InChIKey is URYCHCPGGITLJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2O3S/c1-10-9-19-14(15-10)16-20(17,18)13-8-4-6-11-5-2-3-7-12(11)13/h2-9H,1H3,(H,15,16).
What are the key properties of N-(4-methyl-1,3-oxazol-2-yl)naphthalene-1-sulfonamide?
N-(4-methyl-1,3-oxazol-2-yl)naphthalene-1-sulfonamide has a molecular weight of 288.33 g/mol, XLogP of 2.94, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methyl-1,3-oxazol-2-yl)naphthalene-1-sulfonamide is sourced from PubChem (CID 103948575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).