N-[7-(methanesulfonamido)-9-oxofluoren-2-yl]methanesulfonamide

C15H14N2O5S2 — CID 127039063

IUPACN-[7-(methanesulfonamido)-9-oxofluoren-2-yl]methanesulfonamide
SMILESCS(=O)(=O)Nc1ccc2c(c1)C(=O)c1cc(NS(C)(=O)=O)ccc1-2
InChIInChI=1S/C15H14N2O5S2/c1-23(19,20)16-9-3-5-11-12-6-4-10(17-24(2,21)22)8-14(12)15(18)13(11)7-9/h3-8,16-17H,1-2H3
InChIKeyIFGCWVPOEVQCIR-UHFFFAOYSA-N
MW366.42 g/mol
LogP1.64
Rot. Bonds4

About N-[7-(methanesulfonamido)-9-oxofluoren-2-yl]methanesulfonamide

N-[7-(methanesulfonamido)-9-oxofluoren-2-yl]methanesulfonamide (PubChem CID 127039063) has the molecular formula C15H14N2O5S2 and a molecular weight of 366.42 g/mol. Its IUPAC name is N-[7-(methanesulfonamido)-9-oxofluoren-2-yl]methanesulfonamide.

Molecular Properties

Compound NameN-[7-(methanesulfonamido)-9-oxofluoren-2-yl]methanesulfonamide
PubChem CID127039063
Molecular FormulaC15H14N2O5S2
Molecular Weight366.42 g/mol
Exact Mass366.03
IUPAC NameN-[7-(methanesulfonamido)-9-oxofluoren-2-yl]methanesulfonamide
SMILESCS(=O)(=O)Nc1ccc2c(c1)C(=O)c1cc(NS(C)(=O)=O)ccc1-2
InChIInChI=1S/C15H14N2O5S2/c1-23(19,20)16-9-3-5-11-12-6-4-10(17-24(2,21)22)8-14(12)15(18)13(11)7-9/h3-8,16-17H,1-2H3
InChIKeyIFGCWVPOEVQCIR-UHFFFAOYSA-N
XLogP1.64
TPSA109.41 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.42
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[7-(methanesulfonamido)-9-oxofluoren-2-yl]methanesulfonamide?
The IUPAC name of N-[7-(methanesulfonamido)-9-oxofluoren-2-yl]methanesulfonamide (CID 127039063) is N-[7-(methanesulfonamido)-9-oxofluoren-2-yl]methanesulfonamide.
What is the SMILES notation for N-[7-(methanesulfonamido)-9-oxofluoren-2-yl]methanesulfonamide?
The canonical SMILES for N-[7-(methanesulfonamido)-9-oxofluoren-2-yl]methanesulfonamide is CS(=O)(=O)Nc1ccc2c(c1)C(=O)c1cc(NS(C)(=O)=O)ccc1-2.
What is the InChIKey of N-[7-(methanesulfonamido)-9-oxofluoren-2-yl]methanesulfonamide?
The InChIKey is IFGCWVPOEVQCIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O5S2/c1-23(19,20)16-9-3-5-11-12-6-4-10(17-24(2,21)22)8-14(12)15(18)13(11)7-9/h3-8,16-17H,1-2H3.
What are the key properties of N-[7-(methanesulfonamido)-9-oxofluoren-2-yl]methanesulfonamide?
N-[7-(methanesulfonamido)-9-oxofluoren-2-yl]methanesulfonamide has a molecular weight of 366.42 g/mol, XLogP of 1.64, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[7-(methanesulfonamido)-9-oxofluoren-2-yl]methanesulfonamide is sourced from PubChem (CID 127039063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).