N-[3-[2-amino-4-ethyl-5-(4-hydroxyphenyl)-3-pyridinyl]phenyl]methanesulfonamide

C20H21N3O3S — CID 122531765

IUPACN-[3-[2-amino-4-ethyl-5-(4-hydroxyphenyl)-3-pyridinyl]phenyl]methanesulfonamide
SMILESCCc1c(-c2ccc(O)cc2)cnc(N)c1-c1cccc(NS(C)(=O)=O)c1
InChIInChI=1S/C20H21N3O3S/c1-3-17-18(13-7-9-16(24)10-8-13)12-22-20(21)19(17)14-5-4-6-15(11-14)23-27(2,25)26/h4-12,23-24H,3H2,1-2H3,(H2,21,22)
InChIKeyYNYNUOSJBIBMRT-UHFFFAOYSA-N
MW383.47 g/mol
LogP3.64
Rot. Bonds5

About N-[3-[2-amino-4-ethyl-5-(4-hydroxyphenyl)-3-pyridinyl]phenyl]methanesulfonamide

N-[3-[2-amino-4-ethyl-5-(4-hydroxyphenyl)-3-pyridinyl]phenyl]methanesulfonamide (PubChem CID 122531765) has the molecular formula C20H21N3O3S and a molecular weight of 383.47 g/mol. Its IUPAC name is N-[3-[2-amino-4-ethyl-5-(4-hydroxyphenyl)-3-pyridinyl]phenyl]methanesulfonamide.

Molecular Properties

Compound NameN-[3-[2-amino-4-ethyl-5-(4-hydroxyphenyl)-3-pyridinyl]phenyl]methanesulfonamide
PubChem CID122531765
Molecular FormulaC20H21N3O3S
Molecular Weight383.47 g/mol
Exact Mass383.13
IUPAC NameN-[3-[2-amino-4-ethyl-5-(4-hydroxyphenyl)-3-pyridinyl]phenyl]methanesulfonamide
SMILESCCc1c(-c2ccc(O)cc2)cnc(N)c1-c1cccc(NS(C)(=O)=O)c1
InChIInChI=1S/C20H21N3O3S/c1-3-17-18(13-7-9-16(24)10-8-13)12-22-20(21)19(17)14-5-4-6-15(11-14)23-27(2,25)26/h4-12,23-24H,3H2,1-2H3,(H2,21,22)
InChIKeyYNYNUOSJBIBMRT-UHFFFAOYSA-N
XLogP3.64
TPSA105.31 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.47
LogP ≤ 53.64
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze N-[3-[2-amino-4-ethyl-5-(4-hydroxyphenyl)-3-pyridinyl]phenyl]methanesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-[2-amino-4-ethyl-5-(4-methylphenyl)-3-pyridinyl]phenol
CID 122531787
4-[2-amino-5-[3-[(dimethylamino)methyl]phenyl]-4-ethyl-3-pyridinyl]phenol
CID 122531736
4-(6-amino-5-bromo-4-ethyl-3-pyridinyl)phenol
CID 122531807
5-[6-amino-4-ethyl-5-(4-hydroxyphenyl)-3-pyridinyl]pyridine-2-carbonitrile
CID 122531716
6-amino-3-[3-(methanesulfonamido)phenyl]pyridine-2-carboxylic acid
CID 53229646
N-[3-(4-amino-2-morpholin-4-ylpyrimidin-5-yl)phenyl]methanesulfonamide
CID 66630757
1-[3-[6-amino-4-ethyl-5-(3H-isoindol-5-yl)-3-pyridinyl]phenyl]propan-2-one
CID 152802413
N-[3-[4-amino-3-(2-methyl-1H-indol-5-yl)thieno[3,2-c]pyridin-7-yl]phenyl]methanesulfonamide
CID 18450900
5-[6-amino-4-ethyl-5-(4-hydroxyphenyl)-3-pyridinyl]-N-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethyl]pyridine-2-carboxamide
CID 166555800
N-[4-[6-amino-5-(6-methyl-3-pyridinyl)-3-pyridinyl]phenyl]methanesulfonamide
CID 71038038
3-[6-amino-5-(4-hydroxyphenyl)-3-pyridinyl]-N-(2-hydroxyethyl)benzamide
CID 24821159
N-[3-(4-hydroxy-3-methoxyphenyl)phenyl]methanesulfonamide
CID 53221096

Frequently Asked Questions

What is the IUPAC name of N-[3-[2-amino-4-ethyl-5-(4-hydroxyphenyl)-3-pyridinyl]phenyl]methanesulfonamide?
The IUPAC name of N-[3-[2-amino-4-ethyl-5-(4-hydroxyphenyl)-3-pyridinyl]phenyl]methanesulfonamide (CID 122531765) is N-[3-[2-amino-4-ethyl-5-(4-hydroxyphenyl)-3-pyridinyl]phenyl]methanesulfonamide.
What is the SMILES notation for N-[3-[2-amino-4-ethyl-5-(4-hydroxyphenyl)-3-pyridinyl]phenyl]methanesulfonamide?
The canonical SMILES for N-[3-[2-amino-4-ethyl-5-(4-hydroxyphenyl)-3-pyridinyl]phenyl]methanesulfonamide is CCc1c(-c2ccc(O)cc2)cnc(N)c1-c1cccc(NS(C)(=O)=O)c1.
What is the InChIKey of N-[3-[2-amino-4-ethyl-5-(4-hydroxyphenyl)-3-pyridinyl]phenyl]methanesulfonamide?
The InChIKey is YNYNUOSJBIBMRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N3O3S/c1-3-17-18(13-7-9-16(24)10-8-13)12-22-20(21)19(17)14-5-4-6-15(11-14)23-27(2,25)26/h4-12,23-24H,3H2,1-2H3,(H2,21,22).
What are the key properties of N-[3-[2-amino-4-ethyl-5-(4-hydroxyphenyl)-3-pyridinyl]phenyl]methanesulfonamide?
N-[3-[2-amino-4-ethyl-5-(4-hydroxyphenyl)-3-pyridinyl]phenyl]methanesulfonamide has a molecular weight of 383.47 g/mol, XLogP of 3.64, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[2-amino-4-ethyl-5-(4-hydroxyphenyl)-3-pyridinyl]phenyl]methanesulfonamide is sourced from PubChem (CID 122531765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).