N-(furan-2-ylmethyl)naphthalene-1-sulfonamide

C15H13NO3S — CID 16645062

IUPACN-(furan-2-ylmethyl)naphthalene-1-sulfonamide
SMILESO=S(=O)(NCc1ccco1)c1cccc2ccccc12
InChIInChI=1S/C15H13NO3S/c17-20(18,16-11-13-7-4-10-19-13)15-9-3-6-12-5-1-2-8-14(12)15/h1-10,16H,11H2
InChIKeySTZFCQIXOXUKCW-UHFFFAOYSA-N
MW287.34 g/mol
LogP2.91
Rot. Bonds4

About N-(furan-2-ylmethyl)naphthalene-1-sulfonamide

N-(furan-2-ylmethyl)naphthalene-1-sulfonamide (PubChem CID 16645062) has the molecular formula C15H13NO3S and a molecular weight of 287.34 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)naphthalene-1-sulfonamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)naphthalene-1-sulfonamide
PubChem CID16645062
Molecular FormulaC15H13NO3S
Molecular Weight287.34 g/mol
Exact Mass287.06
IUPAC NameN-(furan-2-ylmethyl)naphthalene-1-sulfonamide
SMILESO=S(=O)(NCc1ccco1)c1cccc2ccccc12
InChIInChI=1S/C15H13NO3S/c17-20(18,16-11-13-7-4-10-19-13)15-9-3-6-12-5-1-2-8-14(12)15/h1-10,16H,11H2
InChIKeySTZFCQIXOXUKCW-UHFFFAOYSA-N
XLogP2.91
TPSA59.31 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.34
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)naphthalene-1-sulfonamide?
The IUPAC name of N-(furan-2-ylmethyl)naphthalene-1-sulfonamide (CID 16645062) is N-(furan-2-ylmethyl)naphthalene-1-sulfonamide.
What is the SMILES notation for N-(furan-2-ylmethyl)naphthalene-1-sulfonamide?
The canonical SMILES for N-(furan-2-ylmethyl)naphthalene-1-sulfonamide is O=S(=O)(NCc1ccco1)c1cccc2ccccc12.
What is the InChIKey of N-(furan-2-ylmethyl)naphthalene-1-sulfonamide?
The InChIKey is STZFCQIXOXUKCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13NO3S/c17-20(18,16-11-13-7-4-10-19-13)15-9-3-6-12-5-1-2-8-14(12)15/h1-10,16H,11H2.
What are the key properties of N-(furan-2-ylmethyl)naphthalene-1-sulfonamide?
N-(furan-2-ylmethyl)naphthalene-1-sulfonamide has a molecular weight of 287.34 g/mol, XLogP of 2.91, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)naphthalene-1-sulfonamide is sourced from PubChem (CID 16645062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).