N-[1-[2-(diethylamino)ethyl]indol-5-yl]naphthalene-2-sulfonamide

C24H27N3O2S — CID 11270131

IUPACN-[1-[2-(diethylamino)ethyl]indol-5-yl]naphthalene-2-sulfonamide
SMILESCCN(CC)CCn1ccc2cc(NS(=O)(=O)c3ccc4ccccc4c3)ccc21
InChIInChI=1S/C24H27N3O2S/c1-3-26(4-2)15-16-27-14-13-21-17-22(10-12-24(21)27)25-30(28,29)23-11-9-19-7-5-6-8-20(19)18-23/h5-14,17-18,25H,3-4,15-16H2,1-2H3
InChIKeyMXYXPBVGIKNZEZ-UHFFFAOYSA-N
MW421.57 g/mol
LogP4.94
Rot. Bonds8

About N-[1-[2-(diethylamino)ethyl]indol-5-yl]naphthalene-2-sulfonamide

N-[1-[2-(diethylamino)ethyl]indol-5-yl]naphthalene-2-sulfonamide (PubChem CID 11270131) has the molecular formula C24H27N3O2S and a molecular weight of 421.57 g/mol. Its IUPAC name is N-[1-[2-(diethylamino)ethyl]indol-5-yl]naphthalene-2-sulfonamide.

Molecular Properties

Compound NameN-[1-[2-(diethylamino)ethyl]indol-5-yl]naphthalene-2-sulfonamide
PubChem CID11270131
Molecular FormulaC24H27N3O2S
Molecular Weight421.57 g/mol
Exact Mass421.18
IUPAC NameN-[1-[2-(diethylamino)ethyl]indol-5-yl]naphthalene-2-sulfonamide
SMILESCCN(CC)CCn1ccc2cc(NS(=O)(=O)c3ccc4ccccc4c3)ccc21
InChIInChI=1S/C24H27N3O2S/c1-3-26(4-2)15-16-27-14-13-21-17-22(10-12-24(21)27)25-30(28,29)23-11-9-19-7-5-6-8-20(19)18-23/h5-14,17-18,25H,3-4,15-16H2,1-2H3
InChIKeyMXYXPBVGIKNZEZ-UHFFFAOYSA-N
XLogP4.94
TPSA54.34 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500421.57
LogP ≤ 54.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-[2-(diethylamino)ethyl]indol-5-yl]-4-phenylbenzenesulfonamide
CID 11201712
N-[1-[2-(diethylamino)ethyl]indol-5-yl]naphthalene-1-sulfonamide
CID 11177658
4-bromo-N-[1-[2-(dimethylamino)ethyl]indol-5-yl]benzenesulfonamide
CID 11676162
N-[1-(2-pyrrolidin-1-ylethyl)indol-6-yl]naphthalene-2-sulfonamide
CID 11166043
N-[2-(diethylamino)ethyl]naphthalene-2-sulfonamide
CID 8716562
1-acetyl-N-(1-propylindol-5-yl)-2,3-dihydroindole-6-sulfonamide
CID 126776307
1-N-methyl-4-N-naphthalen-2-ylbenzene-1,4-disulfonamide
CID 86922484
N-[1-[2-(dimethylamino)ethyl]indol-6-yl]naphthalene-1-sulfonamide
CID 11176859
4-phenyl-N-[1-(3-piperidin-1-ylpropyl)indol-5-yl]benzenesulfonamide
CID 25184428
4-ethoxy-N-naphthalen-2-ylbenzenesulfonamide
CID 7938656
N-[4-(dimethylsulfamoyl)phenyl]naphthalene-2-sulfonamide
CID 2098625
N-(4-propan-2-ylphenyl)naphthalene-2-sulfonamide
CID 3997695

Frequently Asked Questions

What is the IUPAC name of N-[1-[2-(diethylamino)ethyl]indol-5-yl]naphthalene-2-sulfonamide?
The IUPAC name of N-[1-[2-(diethylamino)ethyl]indol-5-yl]naphthalene-2-sulfonamide (CID 11270131) is N-[1-[2-(diethylamino)ethyl]indol-5-yl]naphthalene-2-sulfonamide.
What is the SMILES notation for N-[1-[2-(diethylamino)ethyl]indol-5-yl]naphthalene-2-sulfonamide?
The canonical SMILES for N-[1-[2-(diethylamino)ethyl]indol-5-yl]naphthalene-2-sulfonamide is CCN(CC)CCn1ccc2cc(NS(=O)(=O)c3ccc4ccccc4c3)ccc21.
What is the InChIKey of N-[1-[2-(diethylamino)ethyl]indol-5-yl]naphthalene-2-sulfonamide?
The InChIKey is MXYXPBVGIKNZEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27N3O2S/c1-3-26(4-2)15-16-27-14-13-21-17-22(10-12-24(21)27)25-30(28,29)23-11-9-19-7-5-6-8-20(19)18-23/h5-14,17-18,25H,3-4,15-16H2,1-2H3.
What are the key properties of N-[1-[2-(diethylamino)ethyl]indol-5-yl]naphthalene-2-sulfonamide?
N-[1-[2-(diethylamino)ethyl]indol-5-yl]naphthalene-2-sulfonamide has a molecular weight of 421.57 g/mol, XLogP of 4.94, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[2-(diethylamino)ethyl]indol-5-yl]naphthalene-2-sulfonamide is sourced from PubChem (CID 11270131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).