4-[5-(6-methoxy-3-pyridinyl)-2-[(6-methoxy-3-pyridinyl)amino]-3-pyridinyl]-6-methyl-1,3,5-triazin-2-amine

C21H20N8O2 — CID 59548229

IUPAC4-[5-(6-methoxy-3-pyridinyl)-2-[(6-methoxy-3-pyridinyl)amino]-3-pyridinyl]-6-methyl-1,3,5-triazin-2-amine
SMILESCOc1ccc(Nc2ncc(-c3ccc(OC)nc3)cc2-c2nc(C)nc(N)n2)cn1
InChIInChI=1S/C21H20N8O2/c1-12-26-20(29-21(22)27-12)16-8-14(13-4-6-17(30-2)23-9-13)10-25-19(16)28-15-5-7-18(31-3)24-11-15/h4-11H,1-3H3,(H,25,28)(H2,22,26,27,29)
InChIKeyWKAWCRZBKMFCIS-UHFFFAOYSA-N
MW416.45 g/mol
LogP3.04
Rot. Bonds6

About 4-[5-(6-methoxy-3-pyridinyl)-2-[(6-methoxy-3-pyridinyl)amino]-3-pyridinyl]-6-methyl-1,3,5-triazin-2-amine

4-[5-(6-methoxy-3-pyridinyl)-2-[(6-methoxy-3-pyridinyl)amino]-3-pyridinyl]-6-methyl-1,3,5-triazin-2-amine (PubChem CID 59548229) has the molecular formula C21H20N8O2 and a molecular weight of 416.45 g/mol. Its IUPAC name is 4-[5-(6-methoxy-3-pyridinyl)-2-[(6-methoxy-3-pyridinyl)amino]-3-pyridinyl]-6-methyl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-[5-(6-methoxy-3-pyridinyl)-2-[(6-methoxy-3-pyridinyl)amino]-3-pyridinyl]-6-methyl-1,3,5-triazin-2-amine
PubChem CID59548229
Molecular FormulaC21H20N8O2
Molecular Weight416.45 g/mol
Exact Mass416.17
IUPAC Name4-[5-(6-methoxy-3-pyridinyl)-2-[(6-methoxy-3-pyridinyl)amino]-3-pyridinyl]-6-methyl-1,3,5-triazin-2-amine
SMILESCOc1ccc(Nc2ncc(-c3ccc(OC)nc3)cc2-c2nc(C)nc(N)n2)cn1
InChIInChI=1S/C21H20N8O2/c1-12-26-20(29-21(22)27-12)16-8-14(13-4-6-17(30-2)23-9-13)10-25-19(16)28-15-5-7-18(31-3)24-11-15/h4-11H,1-3H3,(H,25,28)(H2,22,26,27,29)
InChIKeyWKAWCRZBKMFCIS-UHFFFAOYSA-N
XLogP3.04
TPSA133.85 Ų
H-Bond Donors2
H-Bond Acceptors10
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.45
LogP ≤ 53.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1010

Analyze 4-[5-(6-methoxy-3-pyridinyl)-2-[(6-methoxy-3-pyridinyl)amino]-3-pyridinyl]-6-methyl-1,3,5-triazin-2-amine with MolForge

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Launch Full Analysis

Related Compounds

4-(2-[(5-Fluoro-6-Methoxypyridin-3-Yl)amino]-5-{(1r)-1-[4-(Methylsulfonyl)piperazin-1-Yl]ethyl}pyridin-3-Yl)-6-Methyl-1,3,5-Triazin-2-Amine
CID 56947516
4-(2-((6-Methoxypyridin-3-yl)amino)-5-((4-(methylsulfonyl)piperazin-1-yl)methyl)pyridin-3-yl)-6-methyl-1,3,5-triazin-2-amine
CID 49784894
N-{4-[3-(6-methoxypyridin-3-yl)-1H-pyrrolo[3,2-b]pyridin-2-yl]pyridin-2-yl}acetamide
CID 121411874
2-(4-(2-(2-methoxypyridin-3-yl)-3H-imidazo[4,5-b]pyridin-6-yl)piperidin-1-yl)-N-methylethanamine
CID 45487354
4-[2-[(5-fluoro-6-methoxypyridin-3-yl)amino]-5-[(1S)-1-(4-methylsulfonylpiperazin-1-yl)ethyl]pyridin-3-yl]-6-methyl-1,3,5-triazin-2-amine
CID 59548184
(S)-4-(2-(5-fluoro-6-methoxypyridin-3-ylamino)-5-((2-methyl-4-(methylsulfonyl)piperazin-1-yl)methyl)pyridin-3-yl)-6-methyl-1,3,5-triazin-2-amine
CID 59548278
4-[2-[(5-fluoro-6-methoxy-3-pyridinyl)amino]-5-[(1R)-1-[(2S)-2-methyl-4-methylsulfonylpiperazin-1-yl]ethyl]-3-pyridinyl]-6-methyl-1,3,5-triazin-2-amine
CID 59548322
(R)-4-(2-(5-Fluoro-6-methoxypyridin-3-ylamino)-5-((2-methyl-4-(methylsulfonyl)piperazin-1-YL)methyl)pyridin-3-YL)-6-methyl-1,3,5-triazin-2-amine
CID 59548458
4-(2-(6-Methoxypyridin-3-ylamino)-5-(4-(methylsulfonyl)benzyl)pyridin-3-yl)-6-methyl-1,3,5-triazin-2-amine
CID 59548462
6-(2-Methoxyphenyl)-N~4~,N~4~-Bis[(Pyridin-2-Yl)methyl]pyrimidine-2,4-Diamine
CID 124220260
4-[2-[(5-fluoro-6-methoxy-3-pyridinyl)amino]-5-[(1R)-1-(4-methylsulfonylpiperazin-1-ium-1-yl)ethyl]-3-pyridinyl]-6-methyl-1,3,5-triazin-2-amine
CID 72200938
[4-(2-methyl-4-pyridinyl)phenyl] N-(5-pyrazin-2-yl-2-pyridinyl)carbamate
CID 122192848

Frequently Asked Questions

What is the IUPAC name of 4-[5-(6-methoxy-3-pyridinyl)-2-[(6-methoxy-3-pyridinyl)amino]-3-pyridinyl]-6-methyl-1,3,5-triazin-2-amine?
The IUPAC name of 4-[5-(6-methoxy-3-pyridinyl)-2-[(6-methoxy-3-pyridinyl)amino]-3-pyridinyl]-6-methyl-1,3,5-triazin-2-amine (CID 59548229) is 4-[5-(6-methoxy-3-pyridinyl)-2-[(6-methoxy-3-pyridinyl)amino]-3-pyridinyl]-6-methyl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-[5-(6-methoxy-3-pyridinyl)-2-[(6-methoxy-3-pyridinyl)amino]-3-pyridinyl]-6-methyl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-[5-(6-methoxy-3-pyridinyl)-2-[(6-methoxy-3-pyridinyl)amino]-3-pyridinyl]-6-methyl-1,3,5-triazin-2-amine is COc1ccc(Nc2ncc(-c3ccc(OC)nc3)cc2-c2nc(C)nc(N)n2)cn1.
What is the InChIKey of 4-[5-(6-methoxy-3-pyridinyl)-2-[(6-methoxy-3-pyridinyl)amino]-3-pyridinyl]-6-methyl-1,3,5-triazin-2-amine?
The InChIKey is WKAWCRZBKMFCIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N8O2/c1-12-26-20(29-21(22)27-12)16-8-14(13-4-6-17(30-2)23-9-13)10-25-19(16)28-15-5-7-18(31-3)24-11-15/h4-11H,1-3H3,(H,25,28)(H2,22,26,27,29).
What are the key properties of 4-[5-(6-methoxy-3-pyridinyl)-2-[(6-methoxy-3-pyridinyl)amino]-3-pyridinyl]-6-methyl-1,3,5-triazin-2-amine?
4-[5-(6-methoxy-3-pyridinyl)-2-[(6-methoxy-3-pyridinyl)amino]-3-pyridinyl]-6-methyl-1,3,5-triazin-2-amine has a molecular weight of 416.45 g/mol, XLogP of 3.04, 6 rotatable bonds, 2 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-(6-methoxy-3-pyridinyl)-2-[(6-methoxy-3-pyridinyl)amino]-3-pyridinyl]-6-methyl-1,3,5-triazin-2-amine is sourced from PubChem (CID 59548229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).