N-[4-(7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-yl)oxycyclohexyl]pyrimidin-2-amine

C20H25N7O2 — CID 170394462

IUPACN-[4-(7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-yl)oxycyclohexyl]pyrimidin-2-amine
SMILESc1cnc(NC2CCC(Oc3nc(N4CCOCC4)cc4nccn34)CC2)nc1
InChIInChI=1S/C20H25N7O2/c1-6-22-19(23-7-1)24-15-2-4-16(5-3-15)29-20-25-18(26-10-12-28-13-11-26)14-17-21-8-9-27(17)20/h1,6-9,14-16H,2-5,10-13H2,(H,22,23,24)
InChIKeyNAXMWHMUTQOICI-UHFFFAOYSA-N
MW395.47 g/mol
LogP2.16
Rot. Bonds5

About N-[4-(7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-yl)oxycyclohexyl]pyrimidin-2-amine

N-[4-(7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-yl)oxycyclohexyl]pyrimidin-2-amine (PubChem CID 170394462) has the molecular formula C20H25N7O2 and a molecular weight of 395.47 g/mol. Its IUPAC name is N-[4-(7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-yl)oxycyclohexyl]pyrimidin-2-amine.

Molecular Properties

Compound NameN-[4-(7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-yl)oxycyclohexyl]pyrimidin-2-amine
PubChem CID170394462
Molecular FormulaC20H25N7O2
Molecular Weight395.47 g/mol
Exact Mass395.21
IUPAC NameN-[4-(7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-yl)oxycyclohexyl]pyrimidin-2-amine
SMILESc1cnc(NC2CCC(Oc3nc(N4CCOCC4)cc4nccn34)CC2)nc1
InChIInChI=1S/C20H25N7O2/c1-6-22-19(23-7-1)24-15-2-4-16(5-3-15)29-20-25-18(26-10-12-28-13-11-26)14-17-21-8-9-27(17)20/h1,6-9,14-16H,2-5,10-13H2,(H,22,23,24)
InChIKeyNAXMWHMUTQOICI-UHFFFAOYSA-N
XLogP2.16
TPSA89.70 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.47
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

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Frequently Asked Questions

What is the IUPAC name of N-[4-(7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-yl)oxycyclohexyl]pyrimidin-2-amine?
The IUPAC name of N-[4-(7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-yl)oxycyclohexyl]pyrimidin-2-amine (CID 170394462) is N-[4-(7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-yl)oxycyclohexyl]pyrimidin-2-amine.
What is the SMILES notation for N-[4-(7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-yl)oxycyclohexyl]pyrimidin-2-amine?
The canonical SMILES for N-[4-(7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-yl)oxycyclohexyl]pyrimidin-2-amine is c1cnc(NC2CCC(Oc3nc(N4CCOCC4)cc4nccn34)CC2)nc1.
What is the InChIKey of N-[4-(7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-yl)oxycyclohexyl]pyrimidin-2-amine?
The InChIKey is NAXMWHMUTQOICI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N7O2/c1-6-22-19(23-7-1)24-15-2-4-16(5-3-15)29-20-25-18(26-10-12-28-13-11-26)14-17-21-8-9-27(17)20/h1,6-9,14-16H,2-5,10-13H2,(H,22,23,24).
What are the key properties of N-[4-(7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-yl)oxycyclohexyl]pyrimidin-2-amine?
N-[4-(7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-yl)oxycyclohexyl]pyrimidin-2-amine has a molecular weight of 395.47 g/mol, XLogP of 2.16, 5 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-yl)oxycyclohexyl]pyrimidin-2-amine is sourced from PubChem (CID 170394462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).