4-ethyl-N-[5-(4-ethylpiperazin-1-yl)-2-pyridinyl]benzenesulfonamide

C19H26N4O2S — CID 113026011

IUPAC4-ethyl-N-[5-(4-ethylpiperazin-1-yl)-2-pyridinyl]benzenesulfonamide
SMILESCCc1ccc(S(=O)(=O)Nc2ccc(N3CCN(CC)CC3)cn2)cc1
InChIInChI=1S/C19H26N4O2S/c1-3-16-5-8-18(9-6-16)26(24,25)21-19-10-7-17(15-20-19)23-13-11-22(4-2)12-14-23/h5-10,15H,3-4,11-14H2,1-2H3,(H,20,21)
InChIKeyLEEVCESEANJCLS-UHFFFAOYSA-N
MW374.51 g/mol
LogP2.59
Rot. Bonds6

About 4-ethyl-N-[5-(4-ethylpiperazin-1-yl)-2-pyridinyl]benzenesulfonamide

4-ethyl-N-[5-(4-ethylpiperazin-1-yl)-2-pyridinyl]benzenesulfonamide (PubChem CID 113026011) has the molecular formula C19H26N4O2S and a molecular weight of 374.51 g/mol. Its IUPAC name is 4-ethyl-N-[5-(4-ethylpiperazin-1-yl)-2-pyridinyl]benzenesulfonamide.

Molecular Properties

Compound Name4-ethyl-N-[5-(4-ethylpiperazin-1-yl)-2-pyridinyl]benzenesulfonamide
PubChem CID113026011
Molecular FormulaC19H26N4O2S
Molecular Weight374.51 g/mol
Exact Mass374.18
IUPAC Name4-ethyl-N-[5-(4-ethylpiperazin-1-yl)-2-pyridinyl]benzenesulfonamide
SMILESCCc1ccc(S(=O)(=O)Nc2ccc(N3CCN(CC)CC3)cn2)cc1
InChIInChI=1S/C19H26N4O2S/c1-3-16-5-8-18(9-6-16)26(24,25)21-19-10-7-17(15-20-19)23-13-11-22(4-2)12-14-23/h5-10,15H,3-4,11-14H2,1-2H3,(H,20,21)
InChIKeyLEEVCESEANJCLS-UHFFFAOYSA-N
XLogP2.59
TPSA65.54 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.51
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[5-(4-ethylpiperazin-1-yl)-2-pyridinyl]-2-methylbenzenesulfonamide
CID 113026031
5-chloro-N-[5-(4-ethylpiperazin-1-yl)-2-pyridinyl]thiophene-2-sulfonamide
CID 113026023
4-methyl-N-[5-(4-methylpiperidin-1-yl)-2-pyridinyl]benzenesulfonamide
CID 113024884
N-[5-(4-acetylpiperazin-1-yl)-2-pyridinyl]benzenesulfonamide
CID 113026209
4-ethyl-N-[5-(propan-2-ylamino)-2-pyridinyl]benzenesulfonamide
CID 113023639
3,4-dimethyl-N-(5-pyrrolidin-1-yl-2-pyridinyl)benzenesulfonamide
CID 113024384
N-(4-ethylphenyl)-5-(4-ethylpiperazin-1-yl)pyridine-2-carboxamide
CID 109186830
5-ethyl-N-(5-piperidin-1-yl-2-pyridinyl)thiophene-2-sulfonamide
CID 113024663
4-fluoro-3-methyl-N-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]benzenesulfonamide
CID 113025897
N-[5-(4-methylpiperazin-1-yl)-2-pyridinyl]propane-1-sulfonamide
CID 113025882
N-[5-(4-cyanoanilino)-2-pyridinyl]-4-ethylbenzenesulfonamide
CID 113037323
4-cyclopentyloxy-N-(5-pyrrolidin-1-yl-2-pyridinyl)benzenesulfonamide
CID 113024414

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-[5-(4-ethylpiperazin-1-yl)-2-pyridinyl]benzenesulfonamide?
The IUPAC name of 4-ethyl-N-[5-(4-ethylpiperazin-1-yl)-2-pyridinyl]benzenesulfonamide (CID 113026011) is 4-ethyl-N-[5-(4-ethylpiperazin-1-yl)-2-pyridinyl]benzenesulfonamide.
What is the SMILES notation for 4-ethyl-N-[5-(4-ethylpiperazin-1-yl)-2-pyridinyl]benzenesulfonamide?
The canonical SMILES for 4-ethyl-N-[5-(4-ethylpiperazin-1-yl)-2-pyridinyl]benzenesulfonamide is CCc1ccc(S(=O)(=O)Nc2ccc(N3CCN(CC)CC3)cn2)cc1.
What is the InChIKey of 4-ethyl-N-[5-(4-ethylpiperazin-1-yl)-2-pyridinyl]benzenesulfonamide?
The InChIKey is LEEVCESEANJCLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N4O2S/c1-3-16-5-8-18(9-6-16)26(24,25)21-19-10-7-17(15-20-19)23-13-11-22(4-2)12-14-23/h5-10,15H,3-4,11-14H2,1-2H3,(H,20,21).
What are the key properties of 4-ethyl-N-[5-(4-ethylpiperazin-1-yl)-2-pyridinyl]benzenesulfonamide?
4-ethyl-N-[5-(4-ethylpiperazin-1-yl)-2-pyridinyl]benzenesulfonamide has a molecular weight of 374.51 g/mol, XLogP of 2.59, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-[5-(4-ethylpiperazin-1-yl)-2-pyridinyl]benzenesulfonamide is sourced from PubChem (CID 113026011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).