1-(2-methoxyethyl)-9-pyrimidin-2-yl-1,9-diazaspiro[4.5]decane

C15H24N4O — CID 118738977

IUPAC1-(2-methoxyethyl)-9-pyrimidin-2-yl-1,9-diazaspiro[4.5]decane
SMILESCOCCN1CCCC12CCCN(c1ncccn1)C2
InChIInChI=1S/C15H24N4O/c1-20-12-11-19-10-3-6-15(19)5-2-9-18(13-15)14-16-7-4-8-17-14/h4,7-8H,2-3,5-6,9-13H2,1H3
InChIKeySKXTXPRRFDRKPO-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.56
Rot. Bonds4

About 1-(2-methoxyethyl)-9-pyrimidin-2-yl-1,9-diazaspiro[4.5]decane

1-(2-methoxyethyl)-9-pyrimidin-2-yl-1,9-diazaspiro[4.5]decane (PubChem CID 118738977) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is 1-(2-methoxyethyl)-9-pyrimidin-2-yl-1,9-diazaspiro[4.5]decane.

Molecular Properties

Compound Name1-(2-methoxyethyl)-9-pyrimidin-2-yl-1,9-diazaspiro[4.5]decane
PubChem CID118738977
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC Name1-(2-methoxyethyl)-9-pyrimidin-2-yl-1,9-diazaspiro[4.5]decane
SMILESCOCCN1CCCC12CCCN(c1ncccn1)C2
InChIInChI=1S/C15H24N4O/c1-20-12-11-19-10-3-6-15(19)5-2-9-18(13-15)14-16-7-4-8-17-14/h4,7-8H,2-3,5-6,9-13H2,1H3
InChIKeySKXTXPRRFDRKPO-UHFFFAOYSA-N
XLogP1.56
TPSA41.49 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 1-(2-methoxyethyl)-9-pyrimidin-2-yl-1,9-diazaspiro[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 1-(2-methoxyethyl)-9-pyrimidin-2-yl-1,9-diazaspiro[4.5]decane?
The IUPAC name of 1-(2-methoxyethyl)-9-pyrimidin-2-yl-1,9-diazaspiro[4.5]decane (CID 118738977) is 1-(2-methoxyethyl)-9-pyrimidin-2-yl-1,9-diazaspiro[4.5]decane.
What is the SMILES notation for 1-(2-methoxyethyl)-9-pyrimidin-2-yl-1,9-diazaspiro[4.5]decane?
The canonical SMILES for 1-(2-methoxyethyl)-9-pyrimidin-2-yl-1,9-diazaspiro[4.5]decane is COCCN1CCCC12CCCN(c1ncccn1)C2.
What is the InChIKey of 1-(2-methoxyethyl)-9-pyrimidin-2-yl-1,9-diazaspiro[4.5]decane?
The InChIKey is SKXTXPRRFDRKPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c1-20-12-11-19-10-3-6-15(19)5-2-9-18(13-15)14-16-7-4-8-17-14/h4,7-8H,2-3,5-6,9-13H2,1H3.
What are the key properties of 1-(2-methoxyethyl)-9-pyrimidin-2-yl-1,9-diazaspiro[4.5]decane?
1-(2-methoxyethyl)-9-pyrimidin-2-yl-1,9-diazaspiro[4.5]decane has a molecular weight of 276.38 g/mol, XLogP of 1.56, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethyl)-9-pyrimidin-2-yl-1,9-diazaspiro[4.5]decane is sourced from PubChem (CID 118738977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).