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

C21H25N7O3 — CID 170394583

IUPACN-[4-(7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-yl)oxycyclohexyl]pyrimidine-5-carboxamide
SMILESO=C(NC1CCC(Oc2nc(N3CCOCC3)cc3nccn23)CC1)c1cncnc1
InChIInChI=1S/C21H25N7O3/c29-20(15-12-22-14-23-13-15)25-16-1-3-17(4-2-16)31-21-26-19(27-7-9-30-10-8-27)11-18-24-5-6-28(18)21/h5-6,11-14,16-17H,1-4,7-10H2,(H,25,29)
InChIKeyWRMCCKBAFBKWMO-UHFFFAOYSA-N
MW423.48 g/mol
LogP1.48
Rot. Bonds5

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

N-[4-(7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-yl)oxycyclohexyl]pyrimidine-5-carboxamide (PubChem CID 170394583) has the molecular formula C21H25N7O3 and a molecular weight of 423.48 g/mol. Its IUPAC name is N-[4-(7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-yl)oxycyclohexyl]pyrimidine-5-carboxamide.

Molecular Properties

Compound NameN-[4-(7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-yl)oxycyclohexyl]pyrimidine-5-carboxamide
PubChem CID170394583
Molecular FormulaC21H25N7O3
Molecular Weight423.48 g/mol
Exact Mass423.20
IUPAC NameN-[4-(7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-yl)oxycyclohexyl]pyrimidine-5-carboxamide
SMILESO=C(NC1CCC(Oc2nc(N3CCOCC3)cc3nccn23)CC1)c1cncnc1
InChIInChI=1S/C21H25N7O3/c29-20(15-12-22-14-23-13-15)25-16-1-3-17(4-2-16)31-21-26-19(27-7-9-30-10-8-27)11-18-24-5-6-28(18)21/h5-6,11-14,16-17H,1-4,7-10H2,(H,25,29)
InChIKeyWRMCCKBAFBKWMO-UHFFFAOYSA-N
XLogP1.48
TPSA106.77 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500423.48
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

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Related Compounds

6-(2-aminopyrimidin-5-yl)-N-(4-hydroxycyclohexyl)-8-morpholin-4-ylimidazo[1,2-a]pyrazine-2-carboxamide
CID 46946049
N-[(3R,3aR,7aR)-1-pyrimidin-2-yl-3,3a,5,6,7,7a-hexahydro-2H-pyrano[3,2-b]pyrrol-3-yl]pyrazine-2-carboxamide
CID 97460464
N-(4-((7-morpholinoimidazo[1,2-c]pyrimidin-5-yl)oxy)cyclohexyl)pyrimidin-2-amine
CID 170394462
N-(4-((7-morpholinoimidazo[1,2-c]pyrimidin-5-yl)oxy)cyclohexyl)pyrazin-2-amine
CID 170394465
N-(4-((7-morpholinoimidazo[1,2-c]pyrimidin-5-yl)oxy)cyclohexyl)pyrimidine-2-carboxamide
CID 170394581
N-(4-((7-morpholinoimidazo[1,2-c]pyrimidin-5-yl)oxy)cyclohexyl)pyridazine-4-carboxamide
CID 170394584
2-((4-((7-Morpholino-[1,2,4]triazolo[1,5-c]pyrimidin-5-yl)oxy)cyclohexyl)amino)pyrimidine-5-carboxamide
CID 170394667
tert-butyl N-[4-(7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-yl)oxycyclohexyl]carbamate
CID 170573024
(2Z,4Z)-2,5-diamino-N-[4-(7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-yl)oxycyclohexyl]penta-2,4-dienamide
CID 170573029
4-(7-Morpholin-4-ylimidazo[1,2-c]pyrimidin-5-yl)oxycyclohexan-1-amine
CID 170573046
N'-(3-methoxypiperidin-4-yl)-N'-(2-methylimidazo[1,2-a]pyrazin-6-yl)pyrimidine-5-carbohydrazide
CID 177108601
N'-(3-ethoxypiperidin-4-yl)-N'-(2-methylimidazo[1,2-a]pyrazin-6-yl)pyrimidine-5-carbohydrazide
CID 177108634

Frequently Asked Questions

What is the IUPAC name of N-[4-(7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-yl)oxycyclohexyl]pyrimidine-5-carboxamide?
The IUPAC name of N-[4-(7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-yl)oxycyclohexyl]pyrimidine-5-carboxamide (CID 170394583) is N-[4-(7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-yl)oxycyclohexyl]pyrimidine-5-carboxamide.
What is the SMILES notation for N-[4-(7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-yl)oxycyclohexyl]pyrimidine-5-carboxamide?
The canonical SMILES for N-[4-(7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-yl)oxycyclohexyl]pyrimidine-5-carboxamide is O=C(NC1CCC(Oc2nc(N3CCOCC3)cc3nccn23)CC1)c1cncnc1.
What is the InChIKey of N-[4-(7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-yl)oxycyclohexyl]pyrimidine-5-carboxamide?
The InChIKey is WRMCCKBAFBKWMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N7O3/c29-20(15-12-22-14-23-13-15)25-16-1-3-17(4-2-16)31-21-26-19(27-7-9-30-10-8-27)11-18-24-5-6-28(18)21/h5-6,11-14,16-17H,1-4,7-10H2,(H,25,29).
What are the key properties of N-[4-(7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-yl)oxycyclohexyl]pyrimidine-5-carboxamide?
N-[4-(7-morpholin-4-ylimidazo[1,2-c]pyrimidin-5-yl)oxycyclohexyl]pyrimidine-5-carboxamide has a molecular weight of 423.48 g/mol, XLogP of 1.48, 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]pyrimidine-5-carboxamide is sourced from PubChem (CID 170394583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).