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

C20H20N4O3S — CID 67325548

IUPAC4-[6-amino-5-(6-methoxy-3-pyridinyl)-3-pyridinyl]-N-cyclopropylbenzenesulfonamide
SMILESCOc1ccc(-c2cc(-c3ccc(S(=O)(=O)NC4CC4)cc3)cnc2N)cn1
InChIInChI=1S/C20H20N4O3S/c1-27-19-9-4-14(11-22-19)18-10-15(12-23-20(18)21)13-2-7-17(8-3-13)28(25,26)24-16-5-6-16/h2-4,7-12,16,24H,5-6H2,1H3,(H2,21,23)
InChIKeyDCOOJMBFLSZUEL-UHFFFAOYSA-N
MW396.47 g/mol
LogP2.84
Rot. Bonds6

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

4-[6-amino-5-(6-methoxy-3-pyridinyl)-3-pyridinyl]-N-cyclopropylbenzenesulfonamide (PubChem CID 67325548) has the molecular formula C20H20N4O3S and a molecular weight of 396.47 g/mol. Its IUPAC name is 4-[6-amino-5-(6-methoxy-3-pyridinyl)-3-pyridinyl]-N-cyclopropylbenzenesulfonamide.

Molecular Properties

Compound Name4-[6-amino-5-(6-methoxy-3-pyridinyl)-3-pyridinyl]-N-cyclopropylbenzenesulfonamide
PubChem CID67325548
Molecular FormulaC20H20N4O3S
Molecular Weight396.47 g/mol
Exact Mass396.13
IUPAC Name4-[6-amino-5-(6-methoxy-3-pyridinyl)-3-pyridinyl]-N-cyclopropylbenzenesulfonamide
SMILESCOc1ccc(-c2cc(-c3ccc(S(=O)(=O)NC4CC4)cc3)cnc2N)cn1
InChIInChI=1S/C20H20N4O3S/c1-27-19-9-4-14(11-22-19)18-10-15(12-23-20(18)21)13-2-7-17(8-3-13)28(25,26)24-16-5-6-16/h2-4,7-12,16,24H,5-6H2,1H3,(H2,21,23)
InChIKeyDCOOJMBFLSZUEL-UHFFFAOYSA-N
XLogP2.84
TPSA107.20 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.47
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

6-methoxy-N-pyridin-2-ylnaphthalene-2-sulfonamide
CID 747350
6-[2-(4-Methoxyphenyl)ethylamino]pyridine-3-sulfonamide
CID 9405815
2-methoxy-5-propan-2-yl-N-(2-pyridinyl)benzenesulfonamide
CID 977116
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
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
N-[4-[6-amino-5-(6-methoxy-3-pyridyl)-3-pyridyl]phenyl]methanesulfonamide
CID 71461081
3-(6-Methoxy-3-pyridyl)-5-(4-methylsulfonylphenyl)pyrazin-2-amine
CID 71711841

Frequently Asked Questions

What is the IUPAC name of 4-[6-amino-5-(6-methoxy-3-pyridinyl)-3-pyridinyl]-N-cyclopropylbenzenesulfonamide?
The IUPAC name of 4-[6-amino-5-(6-methoxy-3-pyridinyl)-3-pyridinyl]-N-cyclopropylbenzenesulfonamide (CID 67325548) is 4-[6-amino-5-(6-methoxy-3-pyridinyl)-3-pyridinyl]-N-cyclopropylbenzenesulfonamide.
What is the SMILES notation for 4-[6-amino-5-(6-methoxy-3-pyridinyl)-3-pyridinyl]-N-cyclopropylbenzenesulfonamide?
The canonical SMILES for 4-[6-amino-5-(6-methoxy-3-pyridinyl)-3-pyridinyl]-N-cyclopropylbenzenesulfonamide is COc1ccc(-c2cc(-c3ccc(S(=O)(=O)NC4CC4)cc3)cnc2N)cn1.
What is the InChIKey of 4-[6-amino-5-(6-methoxy-3-pyridinyl)-3-pyridinyl]-N-cyclopropylbenzenesulfonamide?
The InChIKey is DCOOJMBFLSZUEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N4O3S/c1-27-19-9-4-14(11-22-19)18-10-15(12-23-20(18)21)13-2-7-17(8-3-13)28(25,26)24-16-5-6-16/h2-4,7-12,16,24H,5-6H2,1H3,(H2,21,23).
What are the key properties of 4-[6-amino-5-(6-methoxy-3-pyridinyl)-3-pyridinyl]-N-cyclopropylbenzenesulfonamide?
4-[6-amino-5-(6-methoxy-3-pyridinyl)-3-pyridinyl]-N-cyclopropylbenzenesulfonamide has a molecular weight of 396.47 g/mol, XLogP of 2.84, 6 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]-N-cyclopropylbenzenesulfonamide is sourced from PubChem (CID 67325548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).