2-(ethylamino)-N-(2-pyridin-4-ylethyl)benzenesulfonamide

C15H19N3O2S — CID 62147752

IUPAC2-(ethylamino)-N-(2-pyridin-4-ylethyl)benzenesulfonamide
SMILESCCNc1ccccc1S(=O)(=O)NCCc1ccncc1
InChIInChI=1S/C15H19N3O2S/c1-2-17-14-5-3-4-6-15(14)21(19,20)18-12-9-13-7-10-16-11-8-13/h3-8,10-11,17-18H,2,9,12H2,1H3
InChIKeyZQOWCUUKYDVQOS-UHFFFAOYSA-N
MW305.40 g/mol
LogP2.03
Rot. Bonds7

About 2-(ethylamino)-N-(2-pyridin-4-ylethyl)benzenesulfonamide

2-(ethylamino)-N-(2-pyridin-4-ylethyl)benzenesulfonamide (PubChem CID 62147752) has the molecular formula C15H19N3O2S and a molecular weight of 305.40 g/mol. Its IUPAC name is 2-(ethylamino)-N-(2-pyridin-4-ylethyl)benzenesulfonamide.

Molecular Properties

Compound Name2-(ethylamino)-N-(2-pyridin-4-ylethyl)benzenesulfonamide
PubChem CID62147752
Molecular FormulaC15H19N3O2S
Molecular Weight305.40 g/mol
Exact Mass305.12
IUPAC Name2-(ethylamino)-N-(2-pyridin-4-ylethyl)benzenesulfonamide
SMILESCCNc1ccccc1S(=O)(=O)NCCc1ccncc1
InChIInChI=1S/C15H19N3O2S/c1-2-17-14-5-3-4-6-15(14)21(19,20)18-12-9-13-7-10-16-11-8-13/h3-8,10-11,17-18H,2,9,12H2,1H3
InChIKeyZQOWCUUKYDVQOS-UHFFFAOYSA-N
XLogP2.03
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.40
LogP ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(ethylamino)-N-[2-(1H-imidazol-5-yl)ethyl]benzenesulfonamide
CID 65231081
2-(ethylamino)-N-pentylbenzenesulfonamide
CID 62162464
2-(ethylamino)-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]benzenesulfonamide
CID 106408027
N,N-dimethyl-2-(2-pyridin-4-ylethylamino)benzenesulfonamide
CID 60904200
N-benzyl-2-(ethylamino)benzenesulfonamide
CID 62148548
N-[2-(diethylamino)ethyl]-2-(ethylamino)benzenesulfonamide
CID 62150418
2-(difluoromethylsulfonyl)-N-(2-pyridin-4-ylethyl)aniline
CID 60904511
5-amino-2-methyl-N-(2-pyridin-4-ylethyl)benzenesulfonamide
CID 60914924
N-[(4-bromophenyl)methyl]-2-(ethylamino)benzenesulfonamide
CID 62150324
4-chloro-2,5-dimethyl-N-(2-pyridin-4-ylethyl)benzenesulfonamide
CID 3747457
2-(ethylamino)-N-(thiophen-2-ylmethyl)benzenesulfonamide
CID 62143225
N-ethyl-4-(2-pyridin-4-ylethylamino)benzenesulfonamide
CID 60904045

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-N-(2-pyridin-4-ylethyl)benzenesulfonamide?
The IUPAC name of 2-(ethylamino)-N-(2-pyridin-4-ylethyl)benzenesulfonamide (CID 62147752) is 2-(ethylamino)-N-(2-pyridin-4-ylethyl)benzenesulfonamide.
What is the SMILES notation for 2-(ethylamino)-N-(2-pyridin-4-ylethyl)benzenesulfonamide?
The canonical SMILES for 2-(ethylamino)-N-(2-pyridin-4-ylethyl)benzenesulfonamide is CCNc1ccccc1S(=O)(=O)NCCc1ccncc1.
What is the InChIKey of 2-(ethylamino)-N-(2-pyridin-4-ylethyl)benzenesulfonamide?
The InChIKey is ZQOWCUUKYDVQOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2S/c1-2-17-14-5-3-4-6-15(14)21(19,20)18-12-9-13-7-10-16-11-8-13/h3-8,10-11,17-18H,2,9,12H2,1H3.
What are the key properties of 2-(ethylamino)-N-(2-pyridin-4-ylethyl)benzenesulfonamide?
2-(ethylamino)-N-(2-pyridin-4-ylethyl)benzenesulfonamide has a molecular weight of 305.40 g/mol, XLogP of 2.03, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-N-(2-pyridin-4-ylethyl)benzenesulfonamide is sourced from PubChem (CID 62147752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).