5-[2-morpholin-4-yl-6-[6-(4-propan-2-ylpiperazin-1-yl)-3-pyridinyl]pyrimidin-4-yl]pyridin-2-amine

C25H32N8O — CID 59507463

IUPAC5-[2-morpholin-4-yl-6-[6-(4-propan-2-ylpiperazin-1-yl)-3-pyridinyl]pyrimidin-4-yl]pyridin-2-amine
SMILESCC(C)N1CCN(c2ccc(-c3cc(-c4ccc(N)nc4)nc(N4CCOCC4)n3)cn2)CC1
InChIInChI=1S/C25H32N8O/c1-18(2)31-7-9-32(10-8-31)24-6-4-20(17-28-24)22-15-21(19-3-5-23(26)27-16-19)29-25(30-22)33-11-13-34-14-12-33/h3-6,15-18H,7-14H2,1-2H3,(H2,26,27)
InChIKeyYMCFCEVWYVWAGM-UHFFFAOYSA-N
MW460.59 g/mol
LogP2.55
Rot. Bonds5

About 5-[2-morpholin-4-yl-6-[6-(4-propan-2-ylpiperazin-1-yl)-3-pyridinyl]pyrimidin-4-yl]pyridin-2-amine

5-[2-morpholin-4-yl-6-[6-(4-propan-2-ylpiperazin-1-yl)-3-pyridinyl]pyrimidin-4-yl]pyridin-2-amine (PubChem CID 59507463) has the molecular formula C25H32N8O and a molecular weight of 460.59 g/mol. Its IUPAC name is 5-[2-morpholin-4-yl-6-[6-(4-propan-2-ylpiperazin-1-yl)-3-pyridinyl]pyrimidin-4-yl]pyridin-2-amine.

Molecular Properties

Compound Name5-[2-morpholin-4-yl-6-[6-(4-propan-2-ylpiperazin-1-yl)-3-pyridinyl]pyrimidin-4-yl]pyridin-2-amine
PubChem CID59507463
Molecular FormulaC25H32N8O
Molecular Weight460.59 g/mol
Exact Mass460.27
IUPAC Name5-[2-morpholin-4-yl-6-[6-(4-propan-2-ylpiperazin-1-yl)-3-pyridinyl]pyrimidin-4-yl]pyridin-2-amine
SMILESCC(C)N1CCN(c2ccc(-c3cc(-c4ccc(N)nc4)nc(N4CCOCC4)n3)cn2)CC1
InChIInChI=1S/C25H32N8O/c1-18(2)31-7-9-32(10-8-31)24-6-4-20(17-28-24)22-15-21(19-3-5-23(26)27-16-19)29-25(30-22)33-11-13-34-14-12-33/h3-6,15-18H,7-14H2,1-2H3,(H2,26,27)
InChIKeyYMCFCEVWYVWAGM-UHFFFAOYSA-N
XLogP2.55
TPSA96.53 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds5
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500460.59
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

Analyze 5-[2-morpholin-4-yl-6-[6-(4-propan-2-ylpiperazin-1-yl)-3-pyridinyl]pyrimidin-4-yl]pyridin-2-amine with MolForge

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Launch Full Analysis

Related Compounds

5-[6-(6-fluoro-3-pyridinyl)-2-morpholin-4-ylpyrimidin-4-yl]pyridin-2-amine
CID 59507831
2-[6-(6-amino-3-pyridinyl)-2-morpholin-4-ylpyrimidin-4-yl]propan-2-ol;chloromethane
CID 145100338
4-[5-(4,6-dimorpholin-4-yl-1,3,5-triazin-2-yl)-2-pyridinyl]morpholine
CID 58507795
5-(2-morpholin-4-ylpyrimidin-5-yl)pyridin-2-amine
CID 122622421
6-(6-amino-3-pyridinyl)-N-(6-methoxy-3-pyridinyl)-2-morpholin-4-ylpyrimidin-4-amine
CID 59507565
6-(6-amino-3-pyridinyl)-N-(3,4-dimethoxyphenyl)-2-morpholin-4-ylpyrimidin-4-amine
CID 59507868
6-methyl-2-(6-morpholin-4-yl-3-pyridinyl)pyrimidin-4-amine
CID 117085161
5-(5-morpholin-4-yl-2-pyridinyl)pyridin-2-amine
CID 172791169
2-[[6-(6-amino-3-pyridinyl)-2-morpholin-4-ylpyrimidin-4-yl]amino]-1-phenylethanol
CID 71177798
6-(6-amino-3-pyridinyl)-N-(3-fluoro-4-pyridinyl)-2-morpholin-4-ylpyrimidin-4-amine
CID 59507630
1-[5-(4-chlorophenyl)-2-pyridinyl]-4-propan-2-ylpiperazine
CID 15951315
4-[6-(2-aminopyrimidin-5-yl)-2-morpholin-4-ylpyrimidin-4-yl]-N,N-dimethylbenzamide
CID 42613285

Frequently Asked Questions

What is the IUPAC name of 5-[2-morpholin-4-yl-6-[6-(4-propan-2-ylpiperazin-1-yl)-3-pyridinyl]pyrimidin-4-yl]pyridin-2-amine?
The IUPAC name of 5-[2-morpholin-4-yl-6-[6-(4-propan-2-ylpiperazin-1-yl)-3-pyridinyl]pyrimidin-4-yl]pyridin-2-amine (CID 59507463) is 5-[2-morpholin-4-yl-6-[6-(4-propan-2-ylpiperazin-1-yl)-3-pyridinyl]pyrimidin-4-yl]pyridin-2-amine.
What is the SMILES notation for 5-[2-morpholin-4-yl-6-[6-(4-propan-2-ylpiperazin-1-yl)-3-pyridinyl]pyrimidin-4-yl]pyridin-2-amine?
The canonical SMILES for 5-[2-morpholin-4-yl-6-[6-(4-propan-2-ylpiperazin-1-yl)-3-pyridinyl]pyrimidin-4-yl]pyridin-2-amine is CC(C)N1CCN(c2ccc(-c3cc(-c4ccc(N)nc4)nc(N4CCOCC4)n3)cn2)CC1.
What is the InChIKey of 5-[2-morpholin-4-yl-6-[6-(4-propan-2-ylpiperazin-1-yl)-3-pyridinyl]pyrimidin-4-yl]pyridin-2-amine?
The InChIKey is YMCFCEVWYVWAGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H32N8O/c1-18(2)31-7-9-32(10-8-31)24-6-4-20(17-28-24)22-15-21(19-3-5-23(26)27-16-19)29-25(30-22)33-11-13-34-14-12-33/h3-6,15-18H,7-14H2,1-2H3,(H2,26,27).
What are the key properties of 5-[2-morpholin-4-yl-6-[6-(4-propan-2-ylpiperazin-1-yl)-3-pyridinyl]pyrimidin-4-yl]pyridin-2-amine?
5-[2-morpholin-4-yl-6-[6-(4-propan-2-ylpiperazin-1-yl)-3-pyridinyl]pyrimidin-4-yl]pyridin-2-amine has a molecular weight of 460.59 g/mol, XLogP of 2.55, 5 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-morpholin-4-yl-6-[6-(4-propan-2-ylpiperazin-1-yl)-3-pyridinyl]pyrimidin-4-yl]pyridin-2-amine is sourced from PubChem (CID 59507463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).