N-[5-[2-(3-methoxyphenyl)ethylamino]-2-pyridinyl]methanesulfonamide

C15H19N3O3S — CID 113028442

IUPACN-[5-[2-(3-methoxyphenyl)ethylamino]-2-pyridinyl]methanesulfonamide
SMILESCOc1cccc(CCNc2ccc(NS(C)(=O)=O)nc2)c1
InChIInChI=1S/C15H19N3O3S/c1-21-14-5-3-4-12(10-14)8-9-16-13-6-7-15(17-11-13)18-22(2,19)20/h3-7,10-11,16H,8-9H2,1-2H3,(H,17,18)
InChIKeyIXOARCFDDHTFKX-UHFFFAOYSA-N
MW321.40 g/mol
LogP2.12
Rot. Bonds7

About N-[5-[2-(3-methoxyphenyl)ethylamino]-2-pyridinyl]methanesulfonamide

N-[5-[2-(3-methoxyphenyl)ethylamino]-2-pyridinyl]methanesulfonamide (PubChem CID 113028442) has the molecular formula C15H19N3O3S and a molecular weight of 321.40 g/mol. Its IUPAC name is N-[5-[2-(3-methoxyphenyl)ethylamino]-2-pyridinyl]methanesulfonamide.

Molecular Properties

Compound NameN-[5-[2-(3-methoxyphenyl)ethylamino]-2-pyridinyl]methanesulfonamide
PubChem CID113028442
Molecular FormulaC15H19N3O3S
Molecular Weight321.40 g/mol
Exact Mass321.11
IUPAC NameN-[5-[2-(3-methoxyphenyl)ethylamino]-2-pyridinyl]methanesulfonamide
SMILESCOc1cccc(CCNc2ccc(NS(C)(=O)=O)nc2)c1
InChIInChI=1S/C15H19N3O3S/c1-21-14-5-3-4-12(10-14)8-9-16-13-6-7-15(17-11-13)18-22(2,19)20/h3-7,10-11,16H,8-9H2,1-2H3,(H,17,18)
InChIKeyIXOARCFDDHTFKX-UHFFFAOYSA-N
XLogP2.12
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.40
LogP ≤ 52.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[5-[2-(3-methoxyphenyl)ethylamino]-2-pyridinyl]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

N-[5-[2-(3-methoxyphenyl)ethylamino]-2-pyridinyl]-3-methylbenzenesulfonamide
CID 113028450
6-methoxy-N-[2-(3-methoxyphenyl)ethyl]pyridin-3-amine
CID 23440804
5-methoxy-N-[2-(3-methoxyphenyl)ethyl]pyridin-2-amine
CID 104861065
N-[5-[2-(3-methoxyphenyl)ethylamino]-2-pyridinyl]cyclopropanecarboxamide
CID 113028392
N-[6-[2-(3-methoxyphenyl)ethylamino]-3-pyridinyl]-2-methylpropanamide
CID 113013416
N-[5-[2-(3-methoxyphenyl)ethylamino]-2-pyridinyl]-3,4-dimethylbenzamide
CID 113028411
4-fluoro-N-[6-[2-(3-methoxyphenyl)ethylamino]-3-pyridinyl]benzamide
CID 113013432
N-[5-(2-methoxyethylamino)-2-pyridinyl]methanesulfonamide
CID 113025091
N-(5-methoxy-2-pyridinyl)methanesulfonamide
CID 67233634
2-chloro-6-fluoro-N-[6-[2-(3-methoxyphenyl)ethylamino]-3-pyridinyl]benzamide
CID 113013450
N-[4-[2-(3-methoxyphenyl)ethylamino]phenyl]thiophene-2-sulfonamide
CID 112983618
N'-hydroxy-5-[2-(3-methoxyphenyl)ethylamino]pyridine-2-carboximidamide
CID 177365516

Frequently Asked Questions

What is the IUPAC name of N-[5-[2-(3-methoxyphenyl)ethylamino]-2-pyridinyl]methanesulfonamide?
The IUPAC name of N-[5-[2-(3-methoxyphenyl)ethylamino]-2-pyridinyl]methanesulfonamide (CID 113028442) is N-[5-[2-(3-methoxyphenyl)ethylamino]-2-pyridinyl]methanesulfonamide.
What is the SMILES notation for N-[5-[2-(3-methoxyphenyl)ethylamino]-2-pyridinyl]methanesulfonamide?
The canonical SMILES for N-[5-[2-(3-methoxyphenyl)ethylamino]-2-pyridinyl]methanesulfonamide is COc1cccc(CCNc2ccc(NS(C)(=O)=O)nc2)c1.
What is the InChIKey of N-[5-[2-(3-methoxyphenyl)ethylamino]-2-pyridinyl]methanesulfonamide?
The InChIKey is IXOARCFDDHTFKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O3S/c1-21-14-5-3-4-12(10-14)8-9-16-13-6-7-15(17-11-13)18-22(2,19)20/h3-7,10-11,16H,8-9H2,1-2H3,(H,17,18).
What are the key properties of N-[5-[2-(3-methoxyphenyl)ethylamino]-2-pyridinyl]methanesulfonamide?
N-[5-[2-(3-methoxyphenyl)ethylamino]-2-pyridinyl]methanesulfonamide has a molecular weight of 321.40 g/mol, XLogP of 2.12, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[2-(3-methoxyphenyl)ethylamino]-2-pyridinyl]methanesulfonamide is sourced from PubChem (CID 113028442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).