N-(9-ethylcarbazol-3-yl)-2-[(5-fluoro-2-methoxyphenyl)sulfonyl-methylamino]acetamide

C24H24FN3O4S — CID 30168613

IUPACN-(9-ethylcarbazol-3-yl)-2-[(5-fluoro-2-methoxyphenyl)sulfonyl-methylamino]acetamide
SMILESCCn1c2ccccc2c2cc(NC(=O)CN(C)S(=O)(=O)c3cc(F)ccc3OC)ccc21
InChIInChI=1S/C24H24FN3O4S/c1-4-28-20-8-6-5-7-18(20)19-14-17(10-11-21(19)28)26-24(29)15-27(2)33(30,31)23-13-16(25)9-12-22(23)32-3/h5-14H,4,15H2,1-3H3,(H,26,29)
InChIKeyFJVAADSCWYJGLX-UHFFFAOYSA-N
MW469.54 g/mol
LogP4.22
Rot. Bonds7

About N-(9-ethylcarbazol-3-yl)-2-[(5-fluoro-2-methoxyphenyl)sulfonyl-methylamino]acetamide

N-(9-ethylcarbazol-3-yl)-2-[(5-fluoro-2-methoxyphenyl)sulfonyl-methylamino]acetamide (PubChem CID 30168613) has the molecular formula C24H24FN3O4S and a molecular weight of 469.54 g/mol. Its IUPAC name is N-(9-ethylcarbazol-3-yl)-2-[(5-fluoro-2-methoxyphenyl)sulfonyl-methylamino]acetamide.

Molecular Properties

Compound NameN-(9-ethylcarbazol-3-yl)-2-[(5-fluoro-2-methoxyphenyl)sulfonyl-methylamino]acetamide
PubChem CID30168613
Molecular FormulaC24H24FN3O4S
Molecular Weight469.54 g/mol
Exact Mass469.15
IUPAC NameN-(9-ethylcarbazol-3-yl)-2-[(5-fluoro-2-methoxyphenyl)sulfonyl-methylamino]acetamide
SMILESCCn1c2ccccc2c2cc(NC(=O)CN(C)S(=O)(=O)c3cc(F)ccc3OC)ccc21
InChIInChI=1S/C24H24FN3O4S/c1-4-28-20-8-6-5-7-18(20)19-14-17(10-11-21(19)28)26-24(29)15-27(2)33(30,31)23-13-16(25)9-12-22(23)32-3/h5-14H,4,15H2,1-3H3,(H,26,29)
InChIKeyFJVAADSCWYJGLX-UHFFFAOYSA-N
XLogP4.22
TPSA80.64 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500469.54
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(9-ethylcarbazol-3-yl)-2-[(4-methoxy-3-methylphenyl)sulfonyl-methylamino]acetamide
CID 45372888
3-(dimethylsulfamoyl)-N-(9-ethylcarbazol-3-yl)-4-methoxybenzamide
CID 45374091
N-(9-ethylcarbazol-3-yl)-2-[methyl(thiophen-2-ylsulfonyl)amino]acetamide
CID 30271978
N-(9-ethylcarbazol-3-yl)-2-(4-fluoro-N-thiophen-2-ylsulfonylanilino)acetamide
CID 30276735
2-[(5-chloro-2-methoxyphenyl)sulfonyl-methylamino]-N-(4-fluorophenyl)acetamide
CID 45373445
2-[benzenesulfonyl(ethyl)amino]-N-(9-ethylcarbazol-3-yl)acetamide
CID 45372945
methyl 5-[[2-[(5-fluoro-2-methoxyphenyl)sulfonyl-methylamino]acetyl]amino]-1-benzothiophene-2-carboxylate
CID 28549040
2-[carbamoyl(methyl)amino]-N-(9-ethylcarbazol-3-yl)acetamide
CID 9400428
2-(3,4-dimethoxyphenyl)sulfanyl-N-(9-ethylcarbazol-3-yl)acetamide
CID 28580453
N-(4-fluorophenyl)-2-[(2-methoxy-5-propan-2-ylphenyl)sulfonyl-methylamino]acetamide
CID 30168353
N-(9-ethylcarbazol-3-yl)-4-methoxy-3-(propan-2-ylsulfamoyl)benzamide
CID 24538264
1-(9-ethylcarbazol-3-yl)-3-(3,4,5-trimethoxyphenyl)urea
CID 2330748

Frequently Asked Questions

What is the IUPAC name of N-(9-ethylcarbazol-3-yl)-2-[(5-fluoro-2-methoxyphenyl)sulfonyl-methylamino]acetamide?
The IUPAC name of N-(9-ethylcarbazol-3-yl)-2-[(5-fluoro-2-methoxyphenyl)sulfonyl-methylamino]acetamide (CID 30168613) is N-(9-ethylcarbazol-3-yl)-2-[(5-fluoro-2-methoxyphenyl)sulfonyl-methylamino]acetamide.
What is the SMILES notation for N-(9-ethylcarbazol-3-yl)-2-[(5-fluoro-2-methoxyphenyl)sulfonyl-methylamino]acetamide?
The canonical SMILES for N-(9-ethylcarbazol-3-yl)-2-[(5-fluoro-2-methoxyphenyl)sulfonyl-methylamino]acetamide is CCn1c2ccccc2c2cc(NC(=O)CN(C)S(=O)(=O)c3cc(F)ccc3OC)ccc21.
What is the InChIKey of N-(9-ethylcarbazol-3-yl)-2-[(5-fluoro-2-methoxyphenyl)sulfonyl-methylamino]acetamide?
The InChIKey is FJVAADSCWYJGLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24FN3O4S/c1-4-28-20-8-6-5-7-18(20)19-14-17(10-11-21(19)28)26-24(29)15-27(2)33(30,31)23-13-16(25)9-12-22(23)32-3/h5-14H,4,15H2,1-3H3,(H,26,29).
What are the key properties of N-(9-ethylcarbazol-3-yl)-2-[(5-fluoro-2-methoxyphenyl)sulfonyl-methylamino]acetamide?
N-(9-ethylcarbazol-3-yl)-2-[(5-fluoro-2-methoxyphenyl)sulfonyl-methylamino]acetamide has a molecular weight of 469.54 g/mol, XLogP of 4.22, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(9-ethylcarbazol-3-yl)-2-[(5-fluoro-2-methoxyphenyl)sulfonyl-methylamino]acetamide is sourced from PubChem (CID 30168613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).