N-[2-(7-sulfamoylnaphthalen-1-yl)ethyl]acetamide

C14H16N2O3S — CID 18175008

IUPACN-[2-(7-sulfamoylnaphthalen-1-yl)ethyl]acetamide
SMILESCC(=O)NCCc1cccc2ccc(S(N)(=O)=O)cc12
InChIInChI=1S/C14H16N2O3S/c1-10(17)16-8-7-12-4-2-3-11-5-6-13(9-14(11)12)20(15,18)19/h2-6,9H,7-8H2,1H3,(H,16,17)(H2,15,18,19)
InChIKeyVUCSLISILBVLDV-UHFFFAOYSA-N
MW292.36 g/mol
LogP1.17
Rot. Bonds4

About N-[2-(7-sulfamoylnaphthalen-1-yl)ethyl]acetamide

N-[2-(7-sulfamoylnaphthalen-1-yl)ethyl]acetamide (PubChem CID 18175008) has the molecular formula C14H16N2O3S and a molecular weight of 292.36 g/mol. Its IUPAC name is N-[2-(7-sulfamoylnaphthalen-1-yl)ethyl]acetamide.

Molecular Properties

Compound NameN-[2-(7-sulfamoylnaphthalen-1-yl)ethyl]acetamide
PubChem CID18175008
Molecular FormulaC14H16N2O3S
Molecular Weight292.36 g/mol
Exact Mass292.09
IUPAC NameN-[2-(7-sulfamoylnaphthalen-1-yl)ethyl]acetamide
SMILESCC(=O)NCCc1cccc2ccc(S(N)(=O)=O)cc12
InChIInChI=1S/C14H16N2O3S/c1-10(17)16-8-7-12-4-2-3-11-5-6-13(9-14(11)12)20(15,18)19/h2-6,9H,7-8H2,1H3,(H,16,17)(H2,15,18,19)
InChIKeyVUCSLISILBVLDV-UHFFFAOYSA-N
XLogP1.17
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.36
LogP ≤ 51.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-(7-sulfamoylnaphthalen-1-yl)ethyl]acetamide?
The IUPAC name of N-[2-(7-sulfamoylnaphthalen-1-yl)ethyl]acetamide (CID 18175008) is N-[2-(7-sulfamoylnaphthalen-1-yl)ethyl]acetamide.
What is the SMILES notation for N-[2-(7-sulfamoylnaphthalen-1-yl)ethyl]acetamide?
The canonical SMILES for N-[2-(7-sulfamoylnaphthalen-1-yl)ethyl]acetamide is CC(=O)NCCc1cccc2ccc(S(N)(=O)=O)cc12.
What is the InChIKey of N-[2-(7-sulfamoylnaphthalen-1-yl)ethyl]acetamide?
The InChIKey is VUCSLISILBVLDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O3S/c1-10(17)16-8-7-12-4-2-3-11-5-6-13(9-14(11)12)20(15,18)19/h2-6,9H,7-8H2,1H3,(H,16,17)(H2,15,18,19).
What are the key properties of N-[2-(7-sulfamoylnaphthalen-1-yl)ethyl]acetamide?
N-[2-(7-sulfamoylnaphthalen-1-yl)ethyl]acetamide has a molecular weight of 292.36 g/mol, XLogP of 1.17, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(7-sulfamoylnaphthalen-1-yl)ethyl]acetamide is sourced from PubChem (CID 18175008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).