8-[5-methyl-6-[(2-methyl-3-pyridinyl)oxy]pyrimidin-4-yl]-1-oxa-8-azaspiro[4.5]decane

C19H24N4O2 — CID 56867005

IUPAC8-[5-methyl-6-[(2-methyl-3-pyridinyl)oxy]pyrimidin-4-yl]-1-oxa-8-azaspiro[4.5]decane
SMILESCc1ncccc1Oc1ncnc(N2CCC3(CCCO3)CC2)c1C
InChIInChI=1S/C19H24N4O2/c1-14-17(23-10-7-19(8-11-23)6-4-12-24-19)21-13-22-18(14)25-16-5-3-9-20-15(16)2/h3,5,9,13H,4,6-8,10-12H2,1-2H3
InChIKeyRCHUBWCZCIBOLB-UHFFFAOYSA-N
MW340.43 g/mol
LogP3.43
Rot. Bonds3

About 8-[5-methyl-6-[(2-methyl-3-pyridinyl)oxy]pyrimidin-4-yl]-1-oxa-8-azaspiro[4.5]decane

8-[5-methyl-6-[(2-methyl-3-pyridinyl)oxy]pyrimidin-4-yl]-1-oxa-8-azaspiro[4.5]decane (PubChem CID 56867005) has the molecular formula C19H24N4O2 and a molecular weight of 340.43 g/mol. Its IUPAC name is 8-[5-methyl-6-[(2-methyl-3-pyridinyl)oxy]pyrimidin-4-yl]-1-oxa-8-azaspiro[4.5]decane.

Molecular Properties

Compound Name8-[5-methyl-6-[(2-methyl-3-pyridinyl)oxy]pyrimidin-4-yl]-1-oxa-8-azaspiro[4.5]decane
PubChem CID56867005
Molecular FormulaC19H24N4O2
Molecular Weight340.43 g/mol
Exact Mass340.19
IUPAC Name8-[5-methyl-6-[(2-methyl-3-pyridinyl)oxy]pyrimidin-4-yl]-1-oxa-8-azaspiro[4.5]decane
SMILESCc1ncccc1Oc1ncnc(N2CCC3(CCCO3)CC2)c1C
InChIInChI=1S/C19H24N4O2/c1-14-17(23-10-7-19(8-11-23)6-4-12-24-19)21-13-22-18(14)25-16-5-3-9-20-15(16)2/h3,5,9,13H,4,6-8,10-12H2,1-2H3
InChIKeyRCHUBWCZCIBOLB-UHFFFAOYSA-N
XLogP3.43
TPSA60.37 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 53.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 8-[5-methyl-6-[(2-methyl-3-pyridinyl)oxy]pyrimidin-4-yl]-1-oxa-8-azaspiro[4.5]decane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 8-[5-methyl-6-[(2-methyl-3-pyridinyl)oxy]pyrimidin-4-yl]-1-oxa-8-azaspiro[4.5]decane?
The IUPAC name of 8-[5-methyl-6-[(2-methyl-3-pyridinyl)oxy]pyrimidin-4-yl]-1-oxa-8-azaspiro[4.5]decane (CID 56867005) is 8-[5-methyl-6-[(2-methyl-3-pyridinyl)oxy]pyrimidin-4-yl]-1-oxa-8-azaspiro[4.5]decane.
What is the SMILES notation for 8-[5-methyl-6-[(2-methyl-3-pyridinyl)oxy]pyrimidin-4-yl]-1-oxa-8-azaspiro[4.5]decane?
The canonical SMILES for 8-[5-methyl-6-[(2-methyl-3-pyridinyl)oxy]pyrimidin-4-yl]-1-oxa-8-azaspiro[4.5]decane is Cc1ncccc1Oc1ncnc(N2CCC3(CCCO3)CC2)c1C.
What is the InChIKey of 8-[5-methyl-6-[(2-methyl-3-pyridinyl)oxy]pyrimidin-4-yl]-1-oxa-8-azaspiro[4.5]decane?
The InChIKey is RCHUBWCZCIBOLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O2/c1-14-17(23-10-7-19(8-11-23)6-4-12-24-19)21-13-22-18(14)25-16-5-3-9-20-15(16)2/h3,5,9,13H,4,6-8,10-12H2,1-2H3.
What are the key properties of 8-[5-methyl-6-[(2-methyl-3-pyridinyl)oxy]pyrimidin-4-yl]-1-oxa-8-azaspiro[4.5]decane?
8-[5-methyl-6-[(2-methyl-3-pyridinyl)oxy]pyrimidin-4-yl]-1-oxa-8-azaspiro[4.5]decane has a molecular weight of 340.43 g/mol, XLogP of 3.43, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[5-methyl-6-[(2-methyl-3-pyridinyl)oxy]pyrimidin-4-yl]-1-oxa-8-azaspiro[4.5]decane is sourced from PubChem (CID 56867005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).