4-(methanesulfonamido)-N-naphthalen-2-ylbenzamide

C18H16N2O3S — CID 2222002

IUPAC4-(methanesulfonamido)-N-naphthalen-2-ylbenzamide
SMILESCS(=O)(=O)Nc1ccc(C(=O)Nc2ccc3ccccc3c2)cc1
InChIInChI=1S/C18H16N2O3S/c1-24(22,23)20-16-9-7-14(8-10-16)18(21)19-17-11-6-13-4-2-3-5-15(13)12-17/h2-12,20H,1H3,(H,19,21)
InChIKeyZTLDNACGPCFENJ-UHFFFAOYSA-N
MW340.40 g/mol
LogP3.46
Rot. Bonds4

About 4-(methanesulfonamido)-N-naphthalen-2-ylbenzamide

4-(methanesulfonamido)-N-naphthalen-2-ylbenzamide (PubChem CID 2222002) has the molecular formula C18H16N2O3S and a molecular weight of 340.40 g/mol. Its IUPAC name is 4-(methanesulfonamido)-N-naphthalen-2-ylbenzamide.

Molecular Properties

Compound Name4-(methanesulfonamido)-N-naphthalen-2-ylbenzamide
PubChem CID2222002
Molecular FormulaC18H16N2O3S
Molecular Weight340.40 g/mol
Exact Mass340.09
IUPAC Name4-(methanesulfonamido)-N-naphthalen-2-ylbenzamide
SMILESCS(=O)(=O)Nc1ccc(C(=O)Nc2ccc3ccccc3c2)cc1
InChIInChI=1S/C18H16N2O3S/c1-24(22,23)20-16-9-7-14(8-10-16)18(21)19-17-11-6-13-4-2-3-5-15(13)12-17/h2-12,20H,1H3,(H,19,21)
InChIKeyZTLDNACGPCFENJ-UHFFFAOYSA-N
XLogP3.46
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.40
LogP ≤ 53.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(methanesulfonamido)-N-naphthalen-2-ylbenzamide?
The IUPAC name of 4-(methanesulfonamido)-N-naphthalen-2-ylbenzamide (CID 2222002) is 4-(methanesulfonamido)-N-naphthalen-2-ylbenzamide.
What is the SMILES notation for 4-(methanesulfonamido)-N-naphthalen-2-ylbenzamide?
The canonical SMILES for 4-(methanesulfonamido)-N-naphthalen-2-ylbenzamide is CS(=O)(=O)Nc1ccc(C(=O)Nc2ccc3ccccc3c2)cc1.
What is the InChIKey of 4-(methanesulfonamido)-N-naphthalen-2-ylbenzamide?
The InChIKey is ZTLDNACGPCFENJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O3S/c1-24(22,23)20-16-9-7-14(8-10-16)18(21)19-17-11-6-13-4-2-3-5-15(13)12-17/h2-12,20H,1H3,(H,19,21).
What are the key properties of 4-(methanesulfonamido)-N-naphthalen-2-ylbenzamide?
4-(methanesulfonamido)-N-naphthalen-2-ylbenzamide has a molecular weight of 340.40 g/mol, XLogP of 3.46, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methanesulfonamido)-N-naphthalen-2-ylbenzamide is sourced from PubChem (CID 2222002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).