4-[6-amino-5-(6-methoxy-3-pyridinyl)-3-pyridinyl]benzenesulfonamide

C17H16N4O3S — CID 53311066

IUPAC4-[6-amino-5-(6-methoxy-3-pyridinyl)-3-pyridinyl]benzenesulfonamide
SMILESCOc1ccc(-c2cc(-c3ccc(S(N)(=O)=O)cc3)cnc2N)cn1
InChIInChI=1S/C17H16N4O3S/c1-24-16-7-4-12(9-20-16)15-8-13(10-21-17(15)18)11-2-5-14(6-3-11)25(19,22)23/h2-10H,1H3,(H2,18,21)(H2,19,22,23)
InChIKeyNJIOVKRXKPMTMJ-UHFFFAOYSA-N
MW356.41 g/mol
LogP2.05
Rot. Bonds4

About 4-[6-amino-5-(6-methoxy-3-pyridinyl)-3-pyridinyl]benzenesulfonamide

4-[6-amino-5-(6-methoxy-3-pyridinyl)-3-pyridinyl]benzenesulfonamide (PubChem CID 53311066) has the molecular formula C17H16N4O3S and a molecular weight of 356.41 g/mol. Its IUPAC name is 4-[6-amino-5-(6-methoxy-3-pyridinyl)-3-pyridinyl]benzenesulfonamide.

Molecular Properties

Compound Name4-[6-amino-5-(6-methoxy-3-pyridinyl)-3-pyridinyl]benzenesulfonamide
PubChem CID53311066
Molecular FormulaC17H16N4O3S
Molecular Weight356.41 g/mol
Exact Mass356.09
IUPAC Name4-[6-amino-5-(6-methoxy-3-pyridinyl)-3-pyridinyl]benzenesulfonamide
SMILESCOc1ccc(-c2cc(-c3ccc(S(N)(=O)=O)cc3)cnc2N)cn1
InChIInChI=1S/C17H16N4O3S/c1-24-16-7-4-12(9-20-16)15-8-13(10-21-17(15)18)11-2-5-14(6-3-11)25(19,22)23/h2-10H,1H3,(H2,18,21)(H2,19,22,23)
InChIKeyNJIOVKRXKPMTMJ-UHFFFAOYSA-N
XLogP2.05
TPSA121.19 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.41
LogP ≤ 52.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

Enitociclib
CID 139593425
US9670161, 1 5-Fluoro-4-(4-fluoro-2-methoxyphenyl)-N-{4-[(methylsulfonyl)methyl]pyridin-2-yl}pyridin-2-amine
CID 73508010
3-(6-Methoxy-3-pyridyl)-5-(4-methylsulfonylphenyl)pyridin-2-amine
CID 44525560
5-(3-Fluoro-4-methylsulfonyl-phenyl)-3-(6-methoxy-3-pyridyl)pyridin-2-amine
CID 53311568
4-[6-amino-5-(6-methoxy-3-pyridyl)-3-pyridyl]-N,N-dimethyl-benzenesulfonamide
CID 53312065
4-[6-amino-5-(6-methoxy-3-pyridyl)-3-pyridyl]-N-methyl-benzenesulfonamide
CID 53312148
3-(6-Methoxy-3-pyridyl)-5-[4-methylsulfonyl-2-(trifluoromethyl)phenyl]pyridin-2-amine
CID 53312322
4-[6-amino-5-(6-methoxy-3-pyridyl)-3-pyridyl]-N-cyclopropyl-benzenesulfonamide
CID 67325548
3-(6-Methoxy-3-pyridyl)-5-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]pyridin-2-amine
CID 68305341
3-(6-Methoxy-3-pyridyl)-5-(4-morpholinosulfonylphenyl)pyridin-2-amine
CID 68305342
6-methoxy-N-pyridin-2-ylnaphthalene-2-sulfonamide
CID 747350
4-Methoxy-naphthalene-1-sulfonic acid (3-methyl-pyridin-2-yl)-amide
CID 2992209

Frequently Asked Questions

What is the IUPAC name of 4-[6-amino-5-(6-methoxy-3-pyridinyl)-3-pyridinyl]benzenesulfonamide?
The IUPAC name of 4-[6-amino-5-(6-methoxy-3-pyridinyl)-3-pyridinyl]benzenesulfonamide (CID 53311066) is 4-[6-amino-5-(6-methoxy-3-pyridinyl)-3-pyridinyl]benzenesulfonamide.
What is the SMILES notation for 4-[6-amino-5-(6-methoxy-3-pyridinyl)-3-pyridinyl]benzenesulfonamide?
The canonical SMILES for 4-[6-amino-5-(6-methoxy-3-pyridinyl)-3-pyridinyl]benzenesulfonamide is COc1ccc(-c2cc(-c3ccc(S(N)(=O)=O)cc3)cnc2N)cn1.
What is the InChIKey of 4-[6-amino-5-(6-methoxy-3-pyridinyl)-3-pyridinyl]benzenesulfonamide?
The InChIKey is NJIOVKRXKPMTMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N4O3S/c1-24-16-7-4-12(9-20-16)15-8-13(10-21-17(15)18)11-2-5-14(6-3-11)25(19,22)23/h2-10H,1H3,(H2,18,21)(H2,19,22,23).
What are the key properties of 4-[6-amino-5-(6-methoxy-3-pyridinyl)-3-pyridinyl]benzenesulfonamide?
4-[6-amino-5-(6-methoxy-3-pyridinyl)-3-pyridinyl]benzenesulfonamide has a molecular weight of 356.41 g/mol, XLogP of 2.05, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[6-amino-5-(6-methoxy-3-pyridinyl)-3-pyridinyl]benzenesulfonamide is sourced from PubChem (CID 53311066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).