3-(methoxymethyl)-8-(6-methyl-2-pyridinyl)-2-propan-2-yl-2,8-diazaspiro[4.5]decane

C19H31N3O — CID 118746630

IUPAC3-(methoxymethyl)-8-(6-methyl-2-pyridinyl)-2-propan-2-yl-2,8-diazaspiro[4.5]decane
SMILESCOCC1CC2(CCN(c3cccc(C)n3)CC2)CN1C(C)C
InChIInChI=1S/C19H31N3O/c1-15(2)22-14-19(12-17(22)13-23-4)8-10-21(11-9-19)18-7-5-6-16(3)20-18/h5-7,15,17H,8-14H2,1-4H3
InChIKeyLQXNGSUKNNYXLJ-UHFFFAOYSA-N
MW317.48 g/mol
LogP3.11
Rot. Bonds4

About 3-(methoxymethyl)-8-(6-methyl-2-pyridinyl)-2-propan-2-yl-2,8-diazaspiro[4.5]decane

3-(methoxymethyl)-8-(6-methyl-2-pyridinyl)-2-propan-2-yl-2,8-diazaspiro[4.5]decane (PubChem CID 118746630) has the molecular formula C19H31N3O and a molecular weight of 317.48 g/mol. Its IUPAC name is 3-(methoxymethyl)-8-(6-methyl-2-pyridinyl)-2-propan-2-yl-2,8-diazaspiro[4.5]decane.

Molecular Properties

Compound Name3-(methoxymethyl)-8-(6-methyl-2-pyridinyl)-2-propan-2-yl-2,8-diazaspiro[4.5]decane
PubChem CID118746630
Molecular FormulaC19H31N3O
Molecular Weight317.48 g/mol
Exact Mass317.25
IUPAC Name3-(methoxymethyl)-8-(6-methyl-2-pyridinyl)-2-propan-2-yl-2,8-diazaspiro[4.5]decane
SMILESCOCC1CC2(CCN(c3cccc(C)n3)CC2)CN1C(C)C
InChIInChI=1S/C19H31N3O/c1-15(2)22-14-19(12-17(22)13-23-4)8-10-21(11-9-19)18-7-5-6-16(3)20-18/h5-7,15,17H,8-14H2,1-4H3
InChIKeyLQXNGSUKNNYXLJ-UHFFFAOYSA-N
XLogP3.11
TPSA28.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.48
LogP ≤ 53.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 3-(methoxymethyl)-8-(6-methyl-2-pyridinyl)-2-propan-2-yl-2,8-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 3-(methoxymethyl)-8-(6-methyl-2-pyridinyl)-2-propan-2-yl-2,8-diazaspiro[4.5]decane?
The IUPAC name of 3-(methoxymethyl)-8-(6-methyl-2-pyridinyl)-2-propan-2-yl-2,8-diazaspiro[4.5]decane (CID 118746630) is 3-(methoxymethyl)-8-(6-methyl-2-pyridinyl)-2-propan-2-yl-2,8-diazaspiro[4.5]decane.
What is the SMILES notation for 3-(methoxymethyl)-8-(6-methyl-2-pyridinyl)-2-propan-2-yl-2,8-diazaspiro[4.5]decane?
The canonical SMILES for 3-(methoxymethyl)-8-(6-methyl-2-pyridinyl)-2-propan-2-yl-2,8-diazaspiro[4.5]decane is COCC1CC2(CCN(c3cccc(C)n3)CC2)CN1C(C)C.
What is the InChIKey of 3-(methoxymethyl)-8-(6-methyl-2-pyridinyl)-2-propan-2-yl-2,8-diazaspiro[4.5]decane?
The InChIKey is LQXNGSUKNNYXLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H31N3O/c1-15(2)22-14-19(12-17(22)13-23-4)8-10-21(11-9-19)18-7-5-6-16(3)20-18/h5-7,15,17H,8-14H2,1-4H3.
What are the key properties of 3-(methoxymethyl)-8-(6-methyl-2-pyridinyl)-2-propan-2-yl-2,8-diazaspiro[4.5]decane?
3-(methoxymethyl)-8-(6-methyl-2-pyridinyl)-2-propan-2-yl-2,8-diazaspiro[4.5]decane has a molecular weight of 317.48 g/mol, XLogP of 3.11, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methoxymethyl)-8-(6-methyl-2-pyridinyl)-2-propan-2-yl-2,8-diazaspiro[4.5]decane is sourced from PubChem (CID 118746630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).