N-(4-methoxyphenyl)sulfonyl-2-methyl-N-phenyl-9H-fluorene-9-carboxamide

C28H23NO4S — CID 102366727

IUPACN-(4-methoxyphenyl)sulfonyl-2-methyl-N-phenyl-9H-fluorene-9-carboxamide
SMILESCOc1ccc(S(=O)(=O)N(C(=O)C2c3ccccc3-c3ccc(C)cc32)c2ccccc2)cc1
InChIInChI=1S/C28H23NO4S/c1-19-12-17-24-23-10-6-7-11-25(23)27(26(24)18-19)28(30)29(20-8-4-3-5-9-20)34(31,32)22-15-13-21(33-2)14-16-22/h3-18,27H,1-2H3
InChIKeyBLWOXZMYKXLTDV-UHFFFAOYSA-N
MW469.56 g/mol
LogP5.54
Rot. Bonds5

About N-(4-methoxyphenyl)sulfonyl-2-methyl-N-phenyl-9H-fluorene-9-carboxamide

N-(4-methoxyphenyl)sulfonyl-2-methyl-N-phenyl-9H-fluorene-9-carboxamide (PubChem CID 102366727) has the molecular formula C28H23NO4S and a molecular weight of 469.56 g/mol. Its IUPAC name is N-(4-methoxyphenyl)sulfonyl-2-methyl-N-phenyl-9H-fluorene-9-carboxamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)sulfonyl-2-methyl-N-phenyl-9H-fluorene-9-carboxamide
PubChem CID102366727
Molecular FormulaC28H23NO4S
Molecular Weight469.56 g/mol
Exact Mass469.13
IUPAC NameN-(4-methoxyphenyl)sulfonyl-2-methyl-N-phenyl-9H-fluorene-9-carboxamide
SMILESCOc1ccc(S(=O)(=O)N(C(=O)C2c3ccccc3-c3ccc(C)cc32)c2ccccc2)cc1
InChIInChI=1S/C28H23NO4S/c1-19-12-17-24-23-10-6-7-11-25(23)27(26(24)18-19)28(30)29(20-8-4-3-5-9-20)34(31,32)22-15-13-21(33-2)14-16-22/h3-18,27H,1-2H3
InChIKeyBLWOXZMYKXLTDV-UHFFFAOYSA-N
XLogP5.54
TPSA63.68 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500469.56
LogP ≤ 55.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-(1,3-dioxoisoindol-2-yl)-N-(4-methoxyphenyl)-N-(4-methylphenyl)sulfonylpropanamide
CID 19219066
tert-butyl N-(4-methoxyphenyl)sulfonyl-N-(3-methylphenyl)carbamate
CID 70074555
N-(4-methylphenyl)sulfonyl-N-phenylcyclohexanecarboxamide
CID 19210513
N-[1-(4-methoxyphenyl)ethyl]-4-methyl-N-phenylbenzenesulfonamide
CID 42841654
N-(benzenesulfonyl)-2-methoxy-N-(4-methoxyphenyl)benzamide
CID 19204610
N-(4-methoxyphenyl)-N-(4-methylphenyl)sulfonyl-2-(2-phenylethyl)benzamide
CID 19210204
N-(4-methoxyphenyl)-3,3-dimethyl-N-(4-methylphenyl)sulfonylbutanamide
CID 19219311
9-(4-methoxyphenyl)sulfonyl-9H-fluorene
CID 11450528
N-[(E)-1,2-dichloroethenyl]-N-(4-methoxyphenyl)-4-methylbenzenesulfonamide
CID 102167641
2-(4-methoxy-N-(4-methylphenyl)sulfonylanilino)propanoic acid
CID 50891410
(E)-N-(4-methoxyphenyl)-3-(4-methylphenyl)-N-(4-methylphenyl)sulfonylprop-2-enamide
CID 19212337
4-(4-methylphenoxy)-N-(4-methylphenyl)sulfonyl-N-phenylbutanamide
CID 19218749

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)sulfonyl-2-methyl-N-phenyl-9H-fluorene-9-carboxamide?
The IUPAC name of N-(4-methoxyphenyl)sulfonyl-2-methyl-N-phenyl-9H-fluorene-9-carboxamide (CID 102366727) is N-(4-methoxyphenyl)sulfonyl-2-methyl-N-phenyl-9H-fluorene-9-carboxamide.
What is the SMILES notation for N-(4-methoxyphenyl)sulfonyl-2-methyl-N-phenyl-9H-fluorene-9-carboxamide?
The canonical SMILES for N-(4-methoxyphenyl)sulfonyl-2-methyl-N-phenyl-9H-fluorene-9-carboxamide is COc1ccc(S(=O)(=O)N(C(=O)C2c3ccccc3-c3ccc(C)cc32)c2ccccc2)cc1.
What is the InChIKey of N-(4-methoxyphenyl)sulfonyl-2-methyl-N-phenyl-9H-fluorene-9-carboxamide?
The InChIKey is BLWOXZMYKXLTDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H23NO4S/c1-19-12-17-24-23-10-6-7-11-25(23)27(26(24)18-19)28(30)29(20-8-4-3-5-9-20)34(31,32)22-15-13-21(33-2)14-16-22/h3-18,27H,1-2H3.
What are the key properties of N-(4-methoxyphenyl)sulfonyl-2-methyl-N-phenyl-9H-fluorene-9-carboxamide?
N-(4-methoxyphenyl)sulfonyl-2-methyl-N-phenyl-9H-fluorene-9-carboxamide has a molecular weight of 469.56 g/mol, XLogP of 5.54, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)sulfonyl-2-methyl-N-phenyl-9H-fluorene-9-carboxamide is sourced from PubChem (CID 102366727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).