6-amino-N-[2-(4-methoxyphenyl)ethyl]pyridine-3-sulfonamide

C14H17N3O3S — CID 62149396

IUPAC6-amino-N-[2-(4-methoxyphenyl)ethyl]pyridine-3-sulfonamide
SMILESCOc1ccc(CCNS(=O)(=O)c2ccc(N)nc2)cc1
InChIInChI=1S/C14H17N3O3S/c1-20-12-4-2-11(3-5-12)8-9-17-21(18,19)13-6-7-14(15)16-10-13/h2-7,10,17H,8-9H2,1H3,(H2,15,16)
InChIKeyROXVZZUOKGHVAZ-UHFFFAOYSA-N
MW307.38 g/mol
LogP1.19
Rot. Bonds6

About 6-amino-N-[2-(4-methoxyphenyl)ethyl]pyridine-3-sulfonamide

6-amino-N-[2-(4-methoxyphenyl)ethyl]pyridine-3-sulfonamide (PubChem CID 62149396) has the molecular formula C14H17N3O3S and a molecular weight of 307.38 g/mol. Its IUPAC name is 6-amino-N-[2-(4-methoxyphenyl)ethyl]pyridine-3-sulfonamide.

Molecular Properties

Compound Name6-amino-N-[2-(4-methoxyphenyl)ethyl]pyridine-3-sulfonamide
PubChem CID62149396
Molecular FormulaC14H17N3O3S
Molecular Weight307.38 g/mol
Exact Mass307.10
IUPAC Name6-amino-N-[2-(4-methoxyphenyl)ethyl]pyridine-3-sulfonamide
SMILESCOc1ccc(CCNS(=O)(=O)c2ccc(N)nc2)cc1
InChIInChI=1S/C14H17N3O3S/c1-20-12-4-2-11(3-5-12)8-9-17-21(18,19)13-6-7-14(15)16-10-13/h2-7,10,17H,8-9H2,1H3,(H2,15,16)
InChIKeyROXVZZUOKGHVAZ-UHFFFAOYSA-N
XLogP1.19
TPSA94.31 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.38
LogP ≤ 51.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-hydrazinyl-N-[2-(4-methoxyphenyl)ethyl]benzenesulfonamide
CID 19844131
N-[2-(4-methoxyphenyl)ethyl]-4-propan-2-yloxybenzenesulfonamide
CID 110755601
4-ethylsulfonyl-N-[2-(4-methoxyphenyl)ethyl]benzenesulfonamide
CID 55915922
4-(2-bromoethyl)-N-[2-(4-methoxyphenyl)ethyl]benzenesulfonamide
CID 110316621
6-amino-N-[(4-methoxyphenyl)methyl]-N-methylpyridine-3-sulfonamide
CID 62158613
N-[2-(3,5-dimethoxyphenyl)ethyl]-4-methoxybenzenesulfonamide
CID 25039968
4-methoxy-N-[2-(4-methoxyphenyl)ethyl]-3-methylbenzenesulfonamide
CID 848320
3-chloro-4-methoxy-N-[2-(4-methoxyphenyl)ethyl]benzenesulfonamide
CID 1254752
6-amino-N-[2-(4-methoxyphenyl)ethyl]pyridine-3-carboxamide
CID 62072605
6-amino-N-(2-methylsulfanylethyl)pyridine-3-sulfonamide
CID 63963985
6-amino-N-(3-ethoxypropyl)pyridine-3-sulfonamide
CID 62144216
4-[2-[(4-ethoxyphenyl)sulfonylamino]ethyl]benzenesulfonamide
CID 2442104

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-[2-(4-methoxyphenyl)ethyl]pyridine-3-sulfonamide?
The IUPAC name of 6-amino-N-[2-(4-methoxyphenyl)ethyl]pyridine-3-sulfonamide (CID 62149396) is 6-amino-N-[2-(4-methoxyphenyl)ethyl]pyridine-3-sulfonamide.
What is the SMILES notation for 6-amino-N-[2-(4-methoxyphenyl)ethyl]pyridine-3-sulfonamide?
The canonical SMILES for 6-amino-N-[2-(4-methoxyphenyl)ethyl]pyridine-3-sulfonamide is COc1ccc(CCNS(=O)(=O)c2ccc(N)nc2)cc1.
What is the InChIKey of 6-amino-N-[2-(4-methoxyphenyl)ethyl]pyridine-3-sulfonamide?
The InChIKey is ROXVZZUOKGHVAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O3S/c1-20-12-4-2-11(3-5-12)8-9-17-21(18,19)13-6-7-14(15)16-10-13/h2-7,10,17H,8-9H2,1H3,(H2,15,16).
What are the key properties of 6-amino-N-[2-(4-methoxyphenyl)ethyl]pyridine-3-sulfonamide?
6-amino-N-[2-(4-methoxyphenyl)ethyl]pyridine-3-sulfonamide has a molecular weight of 307.38 g/mol, XLogP of 1.19, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-[2-(4-methoxyphenyl)ethyl]pyridine-3-sulfonamide is sourced from PubChem (CID 62149396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).