6-(5,6-dimethoxy-3-pyridinyl)-N-(2-methoxy-4-pyridinyl)-2-morpholin-4-ylpyrimidin-4-amine

C21H24N6O4 — CID 126678421

IUPAC6-(5,6-dimethoxy-3-pyridinyl)-N-(2-methoxy-4-pyridinyl)-2-morpholin-4-ylpyrimidin-4-amine
SMILESCOc1cc(Nc2cc(-c3cnc(OC)c(OC)c3)nc(N3CCOCC3)n2)ccn1
InChIInChI=1S/C21H24N6O4/c1-28-17-10-14(13-23-20(17)30-3)16-12-18(24-15-4-5-22-19(11-15)29-2)26-21(25-16)27-6-8-31-9-7-27/h4-5,10-13H,6-9H2,1-3H3,(H,22,24,25,26)
InChIKeyKKUPAVHBGNHIEJ-UHFFFAOYSA-N
MW424.46 g/mol
LogP2.54
Rot. Bonds7

About 6-(5,6-dimethoxy-3-pyridinyl)-N-(2-methoxy-4-pyridinyl)-2-morpholin-4-ylpyrimidin-4-amine

6-(5,6-dimethoxy-3-pyridinyl)-N-(2-methoxy-4-pyridinyl)-2-morpholin-4-ylpyrimidin-4-amine (PubChem CID 126678421) has the molecular formula C21H24N6O4 and a molecular weight of 424.46 g/mol. Its IUPAC name is 6-(5,6-dimethoxy-3-pyridinyl)-N-(2-methoxy-4-pyridinyl)-2-morpholin-4-ylpyrimidin-4-amine.

Molecular Properties

Compound Name6-(5,6-dimethoxy-3-pyridinyl)-N-(2-methoxy-4-pyridinyl)-2-morpholin-4-ylpyrimidin-4-amine
PubChem CID126678421
Molecular FormulaC21H24N6O4
Molecular Weight424.46 g/mol
Exact Mass424.19
IUPAC Name6-(5,6-dimethoxy-3-pyridinyl)-N-(2-methoxy-4-pyridinyl)-2-morpholin-4-ylpyrimidin-4-amine
SMILESCOc1cc(Nc2cc(-c3cnc(OC)c(OC)c3)nc(N3CCOCC3)n2)ccn1
InChIInChI=1S/C21H24N6O4/c1-28-17-10-14(13-23-20(17)30-3)16-12-18(24-15-4-5-22-19(11-15)29-2)26-21(25-16)27-6-8-31-9-7-27/h4-5,10-13H,6-9H2,1-3H3,(H,22,24,25,26)
InChIKeyKKUPAVHBGNHIEJ-UHFFFAOYSA-N
XLogP2.54
TPSA103.75 Ų
H-Bond Donors1
H-Bond Acceptors10
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500424.46
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1010

Analyze 6-(5,6-dimethoxy-3-pyridinyl)-N-(2-methoxy-4-pyridinyl)-2-morpholin-4-ylpyrimidin-4-amine with MolForge

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Related Compounds

6-chloro-N-(2-methoxy-4-pyridinyl)-2-morpholin-4-ylpyrimidin-4-amine
CID 121275927
6-(6-amino-3-pyridinyl)-N-(3,4-dimethoxyphenyl)-2-morpholin-4-ylpyrimidin-4-amine
CID 59507868
6-(2-aminopyrimidin-5-yl)-N-(4-methoxyphenyl)-2-morpholin-4-ylpyrimidin-4-amine
CID 59507485
N-(3,4-dimethoxyphenyl)-2-morpholin-4-yl-6-phenylpyrimidin-4-amine
CID 112935575
6-(6-amino-3-pyridinyl)-N-(6-methoxy-3-pyridinyl)-2-morpholin-4-ylpyrimidin-4-amine
CID 59507565
5-methoxy-N-[6-(6-methyl-3-pyridinyl)-2-morpholin-4-ylpyrimidin-4-yl]quinolin-3-amine
CID 71177828
N-(2-methoxyphenyl)-2-morpholin-4-yl-6-phenylpyrimidin-4-amine
CID 112935565
N-[6-(4-methoxy-3-methylphenyl)-2-morpholin-4-ylpyrimidin-4-yl]-1H-indazol-5-amine
CID 59789810
6-[6-(methylamino)-3-pyridinyl]-2-morpholin-4-yl-N-phenylpyrimidin-4-amine
CID 71177854
3-[6-(4-anilino-2-methoxyanilino)-2-morpholin-4-ylpyrimidin-4-yl]phenol
CID 59789664
N-(4-chlorophenyl)-6-(1-methylpyrazolo[4,5-b]pyridin-6-yl)-2-morpholin-4-ylpyrimidin-4-amine
CID 121272441
6-(6-amino-3-pyridinyl)-N-(3-fluoro-4-pyridinyl)-2-morpholin-4-ylpyrimidin-4-amine
CID 59507630

Frequently Asked Questions

What is the IUPAC name of 6-(5,6-dimethoxy-3-pyridinyl)-N-(2-methoxy-4-pyridinyl)-2-morpholin-4-ylpyrimidin-4-amine?
The IUPAC name of 6-(5,6-dimethoxy-3-pyridinyl)-N-(2-methoxy-4-pyridinyl)-2-morpholin-4-ylpyrimidin-4-amine (CID 126678421) is 6-(5,6-dimethoxy-3-pyridinyl)-N-(2-methoxy-4-pyridinyl)-2-morpholin-4-ylpyrimidin-4-amine.
What is the SMILES notation for 6-(5,6-dimethoxy-3-pyridinyl)-N-(2-methoxy-4-pyridinyl)-2-morpholin-4-ylpyrimidin-4-amine?
The canonical SMILES for 6-(5,6-dimethoxy-3-pyridinyl)-N-(2-methoxy-4-pyridinyl)-2-morpholin-4-ylpyrimidin-4-amine is COc1cc(Nc2cc(-c3cnc(OC)c(OC)c3)nc(N3CCOCC3)n2)ccn1.
What is the InChIKey of 6-(5,6-dimethoxy-3-pyridinyl)-N-(2-methoxy-4-pyridinyl)-2-morpholin-4-ylpyrimidin-4-amine?
The InChIKey is KKUPAVHBGNHIEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N6O4/c1-28-17-10-14(13-23-20(17)30-3)16-12-18(24-15-4-5-22-19(11-15)29-2)26-21(25-16)27-6-8-31-9-7-27/h4-5,10-13H,6-9H2,1-3H3,(H,22,24,25,26).
What are the key properties of 6-(5,6-dimethoxy-3-pyridinyl)-N-(2-methoxy-4-pyridinyl)-2-morpholin-4-ylpyrimidin-4-amine?
6-(5,6-dimethoxy-3-pyridinyl)-N-(2-methoxy-4-pyridinyl)-2-morpholin-4-ylpyrimidin-4-amine has a molecular weight of 424.46 g/mol, XLogP of 2.54, 7 rotatable bonds, 1 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(5,6-dimethoxy-3-pyridinyl)-N-(2-methoxy-4-pyridinyl)-2-morpholin-4-ylpyrimidin-4-amine is sourced from PubChem (CID 126678421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).