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

C24H27N3O2S — CID 11177658

IUPACN-[1-[2-(diethylamino)ethyl]indol-5-yl]naphthalene-1-sulfonamide
SMILESCCN(CC)CCn1ccc2cc(NS(=O)(=O)c3cccc4ccccc34)ccc21
InChIInChI=1S/C24H27N3O2S/c1-3-26(4-2)16-17-27-15-14-20-18-21(12-13-23(20)27)25-30(28,29)24-11-7-9-19-8-5-6-10-22(19)24/h5-15,18,25H,3-4,16-17H2,1-2H3
InChIKeyAXGGGTRPIRGIEN-UHFFFAOYSA-N
MW421.57 g/mol
LogP4.94
Rot. Bonds8

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

N-[1-[2-(diethylamino)ethyl]indol-5-yl]naphthalene-1-sulfonamide (PubChem CID 11177658) 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-1-sulfonamide.

Molecular Properties

Compound NameN-[1-[2-(diethylamino)ethyl]indol-5-yl]naphthalene-1-sulfonamide
PubChem CID11177658
Molecular FormulaC24H27N3O2S
Molecular Weight421.57 g/mol
Exact Mass421.18
IUPAC NameN-[1-[2-(diethylamino)ethyl]indol-5-yl]naphthalene-1-sulfonamide
SMILESCCN(CC)CCn1ccc2cc(NS(=O)(=O)c3cccc4ccccc34)ccc21
InChIInChI=1S/C24H27N3O2S/c1-3-26(4-2)16-17-27-15-14-20-18-21(12-13-23(20)27)25-30(28,29)24-11-7-9-19-8-5-6-10-22(19)24/h5-15,18,25H,3-4,16-17H2,1-2H3
InChIKeyAXGGGTRPIRGIEN-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]naphthalene-2-sulfonamide
CID 11270131
N-[1-[2-(diethylamino)ethyl]indol-5-yl]-4-phenylbenzenesulfonamide
CID 11201712
N-[1-[2-(dimethylamino)ethyl]indol-6-yl]naphthalene-1-sulfonamide
CID 11176859
N-[1-(2-pyrrolidin-1-ylethyl)indol-6-yl]naphthalene-1-sulfonamide
CID 11362134
N-[3-[2-(diethylamino)ethyl]-1H-indol-6-yl]naphthalene-1-sulfonamide
CID 52920134
N-[1-[2-(dimethylamino)ethyl]indol-4-yl]naphthalene-1-sulfonamide
CID 11269402
4-bromo-N-[1-[2-(dimethylamino)ethyl]indol-5-yl]benzenesulfonamide
CID 11676162
N-[1-(1-amino-2-methylpropan-2-yl)indol-6-yl]naphthalene-1-sulfonamide
CID 174508396
N-phenylnaphthalene-1-sulfonamide
CID 3816137
N-(4-anilinophenyl)naphthalene-1-sulfonamide
CID 86182181
N-[4-[[6-[1-[2-(dimethylamino)ethyl]indol-5-yl]pyrimidin-4-yl]amino]phenyl]-2-fluorobenzenesulfonamide
CID 69134890
N-(3-tert-butyl-1-methylpyrazol-5-yl)naphthalene-1-sulfonamide
CID 5220322

Frequently Asked Questions

What is the IUPAC name of N-[1-[2-(diethylamino)ethyl]indol-5-yl]naphthalene-1-sulfonamide?
The IUPAC name of N-[1-[2-(diethylamino)ethyl]indol-5-yl]naphthalene-1-sulfonamide (CID 11177658) is N-[1-[2-(diethylamino)ethyl]indol-5-yl]naphthalene-1-sulfonamide.
What is the SMILES notation for N-[1-[2-(diethylamino)ethyl]indol-5-yl]naphthalene-1-sulfonamide?
The canonical SMILES for N-[1-[2-(diethylamino)ethyl]indol-5-yl]naphthalene-1-sulfonamide is CCN(CC)CCn1ccc2cc(NS(=O)(=O)c3cccc4ccccc34)ccc21.
What is the InChIKey of N-[1-[2-(diethylamino)ethyl]indol-5-yl]naphthalene-1-sulfonamide?
The InChIKey is AXGGGTRPIRGIEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27N3O2S/c1-3-26(4-2)16-17-27-15-14-20-18-21(12-13-23(20)27)25-30(28,29)24-11-7-9-19-8-5-6-10-22(19)24/h5-15,18,25H,3-4,16-17H2,1-2H3.
What are the key properties of N-[1-[2-(diethylamino)ethyl]indol-5-yl]naphthalene-1-sulfonamide?
N-[1-[2-(diethylamino)ethyl]indol-5-yl]naphthalene-1-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-1-sulfonamide is sourced from PubChem (CID 11177658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).